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5-AMINO-2-ETHYL-2-PHENYLVALERIC ACID, HEMIHYDRATE
SpectraBase Compound ID JOrfWEF1j3N
InChI InChI=1S/2C13H19NO2.H2O/c2*1-2-13(12(15)16,9-6-10-14)11-7-4-3-5-8-11;/h2*3-5,7-8H,2,6,9-10,14H2,1H3,(H,15,16);1H2
InChIKey JMNBQGASQHYHJO-UHFFFAOYSA-N
Mol Weight 230.307 g/mol
Molecular Formula C13H19NO2·½H2O
Exact Mass 230.146861 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID VZzOvVz5fC
Name 5-AMINO-2-ETHYL-2-PHENYLVALERIC ACID, HEMIHYDRATE
Source of Sample F. Salmon-Legagneur, University of Rennes, Rennes, France
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H40N2O5
InChI InChI=1S/2C13H19NO2.H2O/c2*1-2-13(12(15)16,9-6-10-14)11-7-4-3-5-8-11;/h2*3-5,7-8H,2,6,9-10,14H2,1H3,(H,15,16);1H2
InChIKey JMNBQGASQHYHJO-UHFFFAOYSA-N
Literature Reference Abstract-Chemical Abstracts= 59, 1747(1963)
Melting Point 269C
Molecular Weight 460.614990
Synonyms VALERIC ACID, 5-AMINO-2-ETHYL- 2-PHENYL-, HEMIHYDRATE
Technique KBr WAFER