B SBSS 75N95022Q00125 - PD.pdf

Sources Sought Number: 75N95022Q00125

Purchase Description

For reference purposes, the Liquid Chromatography High-Resolution Quadrupole Time-of-

Flight (QTOF) with Tandem Mass Spectrometer (LC-MS/MS) that meets the need of this requirement is the Agilent 6546 Quadrupole Time-of-Flight MS Instrument with 1290 Infinity II

LC, as follows:

Line Item No.

Part No. Item Description Qty

1 G6546AA

Agilent 6546 Q-TOF LC/MS System with Agilent Jet Stream source, oil foreline pump, bundled PC, monitor, installation (44K), familiarization (44L), credits for a 4-day Agilent training class where available, and one (1) Year SW Update/Phone Assist (44W)

2 M5960AA

MassHunter Workstation Software for LC/TOF and LC/(Q)TOF with installation (44K), familiarization (44L), and one (1) Year SW Update/Phone Assist (44W). This software includes feature extraction and data quality control.

3* G7120A

1290 Infinity II High Speed Pump. Power range 1300 bar and 5ml/min flow, binary high pressure mixing, lowest delay, highest precision and accuracy. Includes Active Seal Wash, Tool Kit, Solvent Cabinet, bottles and ISET.

4* G7167B

1290 Infinity Multisampler up to 1300 bar for well plates and individual sample containers. Includes 1 sample drawer, 2x 54-vial containers, a needle flush port, 40 uL metering device, 20 uL loop. (for Dual-needle instruments metering is 100 ul and loop size is 20 ul) with installation (44K).

5* G7116B

1290 Infinity II Multicolumn Thermostat. Capacity up to 8 columns, temperature range 4 deg C. to 110 deg C. Includes 1.6uL Quick-Connect Heat Exchanger, Quick-Connect fitting and two Quick-Turn fittings, with Installation (44K).

6* G4231C 2 pos/6 port valve head, 1300 bar with installation (44K) 1

7 G3835AA

Mass Profiler Professional (MPP) as well as installation (44K), familiarization (44L), and one (1) Year SW Update/Phone Assist (44W). This software includes statistical analyses and intuitive visualization tools (e.g., uni- and multi-variate analyses, PCA, clustering, class prediction)

8 G3836AA

Pathway Features for MPP with familiarization (44L), and one (1) Year SW Update/Phone Assist (44W) This software enables pathway enrichment analyses.

9 G3874AA

MassHunter METLIN Metabolite PCDL. Personal Compound Database and Library for ~25000 endogenous metabolites, with ~ 9000 accurate mass MS/MS spectra for over 2300 compounds and RTs for 700 compounds

10 G3876CA

Standalone Forensics Tox PCDL library (contains drugs of abuse).

11 G5883CA

Standalone Mycotoxin Personal Compound Database and Library for current Agilent TOF and Q-TOF LC/MS Systems

12 G6890CA

Extractables and Leachables Accurate Mass PCDL for Agilent LC/MS systems

13 H2149A Method and Application Consulting On-site consulting for a maximum of four (4) participants for five (5) day on-site (includes travel)

14 5043-1759 Flex Bench, Floor with PS 1

15 5043-1735 Drawer for Flex Benches 1

* In addition to the item description provided above, the items listed herein have the following configuration:

Item 3: G7120A with the following configuration:

a. High Speed UCT (033)

b. Jet weaver upgrade kit (070)

c. Prooshell 120 EC-C18,2.1x50mm, 1.9 um

d. Manual DVD for 1220/1260/1290

e. Agilent Lab Advisor Advanced Software

f. Ultra Clean Tubing Kit

g. A-Line Stay Safe Cap Starter Kit

h. V380 Jet Weaver Mixer Upgrade Kit

Item 4: G7167B with the following configuration:

a. MassHunter System Driver

b. Agilent InfinityLab sample thermostat

c. Dual-height drawer kit

d. 1290 Infinity multi-wash option

Item 5: G7116B with the following configuration:

a. Quick-Conn HE ULD (064)

b. Valve drive for 1290 MCT

c. Quick-Connect HE Standard Flow

d. Quick-Connect HE Ultra Low Dispersion

e. Column ID kit for 1290 Infinity II MCT

Item 6: G4231C with the following configuration:

a. Kap kit QCHE G4231C

b. 2/6 cap kit 0.12 mm ID, incl. QC-HE

The salient characteristics of the Liquid Chromatography High-Resolution Quadrupole Time-of-

Flight (QTOF) with Tandem Mass Spectrometer (LC-MS/MS) include:

• Automated optimization of ion optics and full QTOF mass axis calibration, fully integrated part of the mass spectrometer (no manual adjusting of plumbing).

• Transparent and automated introduction of reference masses through a built-in calibrant delivery system with support for real-time internal reference mass correction for MS and MS/MS operation.

• Up to 5 orders of dynamic range within a single spectrum containing co-eluting compounds.

• Analog to Digital Conversion at a minimum of 10 GHz.

• <1ppm mass accuracy within a 3-degree Celsius drift per hour without needing to re-tune, to accommodate temperature variation in the laboratory. Active temperature compensation.

• For maximum uptime and robustness, ion sources are single bend 90-degree orthogonal geometry, in order to minimize chemical noise, carryover, maintenance, and ion suppression.

• Isolation valve included for vent-free capillary maintenance, preventing unnecessary downtime during routine operation.

• Focusing of the electrospray plume at the sampling aperture of the mass spectrometer for optimal ion sampling and peak shape.

• Detection and enhancement signal of fragile molecules that are susceptible to fragmentation and loss within the atmospheric pressure interface of an LCMS.

• Data Dependent MS/MS and Data Independent MS/MS support.

• Options to add on the following additional sources: APCI, APPI, combined ESI/APCI, nanoESI interface, and GC APCI source with fully integrated GC and transfer line control.

• TOF mass resolution of at least 30,000 at m/z 200 and 60,000 at m/z 2,722 after automatic tuning procedure, at full acquisition speed, with a single bend V-shaped flight path.

• Mass measurement accuracy <0.8 ppm RMS error in TOF mode as measured by calculating average error from 10 repeat injections onto an HPLC column under electrospray ionization conditions.

• Mass measurement accuracy <2 ppm RMS error in MS/MS mode as measured by calculating average error from 10 repeat injections onto an HPLC column under electrospray ionization.

• MS sensitivity of 1 pg of reserpine on column under electrospray ionization mode at HPLC flow rate of 400 uL/min with a signal-to-noise ratio of at least 500:1 for the reserpine (M+H)+ signal at m/z 609.2807. Must be achievable while maintaining maximum mass resolution.

• MS/MS sensitivity of 1 pg of reserpine on column under electrospray ionization mode at HPLC flow rate of 400 uL/min with a signal-to-noise ratio of at least 1500:1 RMS for the most intense product ions (m/z 174, 195, 397, 448). Achievable while maintaining maximum mass resolution.

• Resolving power specification (60,000 at 2,722m/z) and simultaneous sensitivity specification shown above for 1 pg of reserpine on column under electrospray ionization mode at HPLC flow rate of 400 uL/min. Both of these criteria must be met under the same instrument conditions – intent is to avoid sacrificing sensitivity or resolution to optimize the other criteria.

• Spectral acquisition rate of 50 spectra/second in MS mode and 30 spectra/second MS/MS mode while maintaining a resolution of 60,000 at m/z 2,722.

• Isotopic fidelity such that the relative isotopic abundance error is less than 5% of the RMS for 10 ESI calibrant ions in positive polarity (RIA error (%) = 100 × (RIAexp – RIAtheo)/ RIAtheo).

• Handling and Shipping to NCATS, FOB Destination.

• Installation and Equipment familiarization on-site (NCATS).

• On-site consulting for at least four (4) participants for five (5) day (includes travel).

• Twelve (12) month warranty on the instruments.

• Ninety (90) days warranty on consumables.

• Twelve (12) months software updates and phone assistance.