The NIST DART-MS Forensics Database is an evaluated collection of in-source collisionally-induced dissociation (is-CID) mass spectra of compounds of interest to the forensics community (e.g. seized drugs, cutting agents, etc.). The is-CID mass spectra were collected using Direct Analysis in Real-Time (DART) Mass Spectrometry (MS), either by NIST scientists or by contributing agencies noted per compound. The database is provided as a general-purpose structure data file (.SDF).

The NIST DART-MS Forensics Database is an evaluated collection of in-source collisionally-induced dissociation (is-CID) mass spectra of compounds of interest to the forensics community (e.g. seized drugs, cutting agents, etc.). The is-CID mass spectra were collected using Direct Analysis in Real-Time (DART) Mass Spectrometry (MS), either by NIST scientists or by contributing agencies noted per compound. The database is provided as a general-purpose structure data file (.SDF).

This report describes the test equipment, process, analysis, and data file formats for the Numisheet 2020 tensile and tension/compression testing of the four materials associated with the Numisheet 2020 conference benchmarks. The four materials include two steel alloys, DP980 for Benchmark 1 and DP1180 for Benchmark 2, and two 6000 series aluminum alloys, AA6xxx-T4 for Benchmark 1 and AA6xxx-T81 for Benchmark 2, that will be referred to here as BM1-DP980, BM2-DP1180, BM1-6xxx-T4, and BM2-6xxx-T81, respectively.

This tutorial provides mechanical drawings, electrical schematics, parts lists, STL files for 3D-printed parts, IGS files, and instructions for automated machining necessary for construction of a dual-protease, subzero, liquid chromatography system for hydrogen-deuterium exchange mass spectrometry. Electrical schematics for construction of a multi-zone temperature controller that regulate to ±0.1 oC are also included in this tutorial.

The spreadsheet file reported herein provides centroid data, descriptive of deuterium uptake, for the Fab Fragment of NISTmAb (PDB: 5K8A) reference material, as measured by the bottom-up hydrogen-deuterium exchange mass spectrometry (HDX-MS) method. The protein sample was incubated in deuterium-rich solutions under uniform pH and salt concentrations between 3.6 degrees C and 25.4 degrees C for seven intervals ranging (0 to 14,400) s plus a control sample that simulates a Fab Fragment immersed for infinite time in D2O.

This Standard Reference Material (SRM) is in the form of chips sized between 0.50 and 1.18 mm sieve openings (35 and 16 mesh). It is intended for use primarily in chemical methods of analysis. Similar material for use in spectrometric methods of analysis is available as SRM 1297. This data is public in the Certificate of Analysis for this material.

SRM 1297 Stainless Steel (SAE 201) - 'This Standard Reference Material (SRM) is intended for use in optical emission and x-ray spectrometric methods of analysis. It is in the form of a disk approximately 32 mm in diameter and 19 mm thick. This data is public in the Certificate of Analysis for this material.

Liquid-chromatography-mass spectrometry (LC-MS) raw data sets from various instruments delivered in their native instrument format. 31 files in all. 7.5 GB data.

Sulfonephthalein pH indicator dyes have historically been noted for impurities originating from the synthesis process which lead to batch to batch differences in pH measurements. Uncertainties up to 0.1 pH units have been attributed to impurities in these reagents.

This database is the product of a multi-year, comprehensive evaluation and expansion of the world's most widely used mass spectral reference library.