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5-Amino-2-cyclohexyl-2-phenylvaleric acid, dihydrate

View entire compound with spectra: 1 FTIR, and 1 Raman

5-Amino-2-cyclohexyl-2-phenylvaleric acid, dihydrate
SpectraBase Compound ID 6CuvCsHdRaj
InChI InChI=1S/C17H25NO2.2H2O/c18-13-7-12-17(16(19)20,14-8-3-1-4-9-14)15-10-5-2-6-11-15;;/h1,3-4,8-9,15H,2,5-7,10-13,18H2,(H,19,20);2*1H2
InChIKey IAXIWGBZEJWLLN-UHFFFAOYSA-N
Mol Weight 311.42 g/mol
Molecular Formula C17H29NO4
Exact Mass 311.209658 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID 81eGhCRIIFe
Name 5-AMINO-2-CYCLOHEXYL-2-PHENYLVALERIC ACID, DIHYDRATE
Source of Sample F. Salmon-Legagneur, University of Rennes, Rennes, France
Copyright Copyright © 1980, 1981-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H29NO4
InChI InChI=1S/C17H25NO2.2H2O/c18-13-7-12-17(16(19)20,14-8-3-1-4-9-14)15-10-5-2-6-11-15;;/h1,3-4,8-9,15H,2,5-7,10-13,18H2,(H,19,20);2*1H2
InChIKey IAXIWGBZEJWLLN-UHFFFAOYSA-N
Literature Reference Abstract-Chemical Abstracts= 59, 1747(1963)
Melting Point 260C
Molecular Weight 311.421997
Synonyms VALERIC ACID, 5-AMINO-2-CYCLOHEXYL- 2-PHENYL-, DIHYDRATE
Technique KBr WAFER