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

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.

Standard Reference Material 131h Refined Cast Iron - This Standard Reference Material (SRM) is intended primarily for use in validation of chemical and instrumental methods of analysis. It can be used to validate value assignment of in-house reference materials and, if necessary, to calibrate carbon/sulfur analyzers. A unit of SRM 131h consists of a bottle containing 100 g of chips. This data is public in the Certificate of Analysis for this material.

Standard Reference Material 1632d Trace Elements in Coal (Bituminous) - This Standard Reference Material (SRM) is intended primarily for use in the evaluation of techniques used in the analysis of coals and materials of a similar matrix. A unit of SRM 1632d consists of 50 g of bituminous coal that was ground to pass a 250 µm (60 mesh) sieve, homogenized, bottled under an argon atmosphere, and sealed in an aluminized bag. This data is public in the Certificate of Analysis for this material.

SRM 1632e Trace Elements in Coal (Bituminous) - This Standard Reference Material (SRM) is intended primarily for use in the evaluation of techniques used in the analysis of coals and materials of a similar matrix.

SRM 1633c Trace Elements in Coal Fly Ash - This Standard Reference Material (SRM) is intended for use in the evaluation of analytical methods for the determination of constituent elements in coal fly ash or materials of a similar matrix. SRM 1633c is a bituminous coal fly ash that was sieved through a nominal sieve opening of 74 µm (200 mesh) and then blended to assure homogeneity. A unit of SRM 1633c consists of 75 g of powdered material. This data is public in the Certificate of Analysis for this material.

SRM 1635a Trace Elements in Coal (Subbituminous) - This Standard Reference Material (SRM) is intended primarily for the evaluation of techniques used in the analysis of coals and materials of a similar matrix. A unit of SRM 1635a consists of 50 g of subbituminous coal that was ground to pass a 250 µm (60 mesh) sieve, homogenized, bottled under an argon atmosphere, and sealed in an aluminized bag. This data is public in the Certificate of Analysis for this material.

SRM 194a Ammonium Dihydrogen Phosphate - This Standard Reference Material (SRM) is a highly purified and homogeneous lot of crystalline ammonium dihydrogen phosphate (NH4H2PO4). It is intended primarily for use as a working standard in the calibration and standardization of procedures employed in the fertilizer industry for the determination of ammoniacal nitrogen and phosphorus. A unit of SRM 194a consists of one bottle containing 90 g of crystalline ammonium dihydrogen phosphate. This data is public in the Certificate of Analysis for this material.

SRM 1950 Metabolites in Frozen Human Plasma - This Standard Reference Material (SRM) is intended primarily for validation of methods for determining metabolites such as fatty acids, electrolytes, vitamins, hormones, and amino acids in human plasma and similar materials. This SRM can also be used for comparison of measurement technologies used in metabolomic studies and for quality assurance when assigning values to in-house reference materials. This SRM is intended to represent "normal" human plasma.