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Sodium phenylpyruvate monohydrate

View entire compound with spectra: 1 NMR, 4 FTIR, and 2 Raman

Sodium phenylpyruvate monohydrate
SpectraBase Compound ID HZRZYVAypuy
InChI InChI=1S/C9H8O3.Na.H2O/c10-8(9(11)12)6-7-4-2-1-3-5-7;;/h1-5H,6H2,(H,11,12);;1H2/q;+1;/p-1
InChIKey ABWVLWHPVBHFLQ-UHFFFAOYSA-M
Mol Weight 204.15676928 g/mol
Molecular Formula C9H9NaO4
Exact Mass 204.039853 g/mol

Attenuated Total Reflectance Infrared (ATR-IR) Spectrum

Attenuated Total Reflectance Infrared (ATR-IR) Spectrum

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SpectraBase Spectrum ID 9lmacLytNSk
Name Sodium phenylpyruvate monohydrate
Source of Sample Alfa Aesar, A Johnson Matthey Company
Catalog Number A14027
Lot Number P02173
CAS Registry Number 122049-54-1
Copyright Copyright © 2015-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H9NaO4
InChI InChI=1S/C9H8O3.Na.H2O/c10-8(9(11)12)6-7-4-2-1-3-5-7;;/h1-5H,6H2,(H,11,12);;1H2/q;+1;/p-1
InChIKey ABWVLWHPVBHFLQ-UHFFFAOYSA-M
Instrument Name Bruker Tensor 27 FT-IR
Physical State Solid
Purity 98%
Sample Type Organic
Source of Spectrum Bio-Rad Laboratories, Inc.
Synonyms Phenylpyruvic acid sodium salt monohydrate
Technique ATR-Neat (DuraSamplIR II)