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(2S)-2-methyl-4-phenylbutanoic acid
SpectraBase Compound ID JUWGh0kyaw3
InChI InChI=1S/C11H14O2/c1-9(11(12)13)7-8-10-5-3-2-4-6-10/h2-6,9H,7-8H2,1H3,(H,12,13)/t9-/m0/s1
InChIKey OCKZHEXBLOOGOC-VIFPVBQESA-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 JvQhHLZLrBf
Name (2S)-2-methyl-4-phenylbutanoic acid
CAS Registry Number 41927-29-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H14O2
InChI InChI=1S/C11H14O2/c1-9(11(12)13)7-8-10-5-3-2-4-6-10/h2-6,9H,7-8H2,1H3,(H,12,13)/t9-/m0/s1
InChIKey OCKZHEXBLOOGOC-VIFPVBQESA-N
Molecular Weight 178.231 g/mol
SMILES OC(=O)[C@](CCc1ccccc1)(C)[H]
SPLASH splash10-056u-9400000000-8d834d287288834fc0a6
Source of Spectrum KC-1987-2433-0
Synonyms (2S)-2-methyl-4-phenyl-butanoic acid
Wiley ID 1174369