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Sodium hippurate hydrate

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

Sodium hippurate hydrate
SpectraBase Compound ID 6jYimfHplMy
InChI InChI=1S/C9H9NO3.Na.O/c11-8(12)6-10-9(13)7-4-2-1-3-5-7;;/h1-5H,6H2,(H,10,13)(H,11,12);;/q;+1;/p-1
InChIKey GEWMHXKKRFDZIZ-UHFFFAOYSA-M
Mol Weight 217.15576928 g/mol
Molecular Formula C9H8NNaO4
Exact Mass 217.035102 g/mol

Attenuated Total Reflectance Infrared (ATR-IR) Spectrum

Attenuated Total Reflectance Infrared (ATR-IR) Spectrum

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SpectraBase Spectrum ID pw1wXA0Xfv
Name Sodium hippurate hydrate
Source of Sample Aldrich
Catalog Number 271640
CAS Registry Number 532-94-5
Comments MW calculated on anhydrous base
Copyright Copyright © 2018-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2018-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H8NNaO3*xH2O
InChI InChI=1S/C9H9NO3.Na.O/c11-8(12)6-10-9(13)7-4-2-1-3-5-7;;/h1-5H,6H2,(H,10,13)(H,11,12);;/q;+1;/p-1
InChIKey GEWMHXKKRFDZIZ-UHFFFAOYSA-M
Purity 99%
Synonyms Hippuric acid sodium salt hydrate
Wiley ID SIAL_ATR-IR_013396