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5-Phenylvaleric acid

View entire compound with spectra: 4 NMR, 7 FTIR, and 5 MS (GC)

5-Phenylvaleric acid
SpectraBase Compound ID 6VGlTrNiMfq
InChI InChI=1S/C11H14O2/c12-11(13)9-5-4-8-10-6-2-1-3-7-10/h1-3,6-7H,4-5,8-9H2,(H,12,13)
InChIKey BYHDDXPKOZIZRV-UHFFFAOYSA-N
Mol Weight 178.23 g/mol
Molecular Formula C11H14O2
Exact Mass 178.09938 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IHUxpPZeWxU
Name 5-Phenylvaleric acid
CAS Registry Number 2270-20-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H14O2
InChI InChI=1S/C11H14O2/c12-11(13)9-5-4-8-10-6-2-1-3-7-10/h1-3,6-7H,4-5,8-9H2,(H,12,13)
InChIKey BYHDDXPKOZIZRV-UHFFFAOYSA-N
Molecular Weight 178.231 g/mol
SMILES OC(CCCCc1ccccc1)=O
SPLASH splash10-0006-9400000000-7f526502a3bd88b01b12
Synonyms .delta.-Phenylvaleric acid 5-Phenyl-pentanoic acid 5-Phenylvalerate delta-Phenylvaleric acid Phenylvaleric acid Valeric acid, 5-phenyl- AI3-05952 BRN 2049062 EINECS 218-872-8 NSC 65637
Wiley ID 1474576