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Benzenepropanoic acid, .alpha.-butyl-, (R)-
SpectraBase Compound ID FeTMG8TaZSO
InChI InChI=1S/C13H18O2/c1-2-3-9-12(13(14)15)10-11-7-5-4-6-8-11/h4-8,12H,2-3,9-10H2,1H3,(H,14,15)/t12-/m1/s1
InChIKey NQQBWCDFWBAYBJ-GFCCVEGCSA-N
Mol Weight 206.28 g/mol
Molecular Formula C13H18O2
Exact Mass 206.13068 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8fhDX4IC6jh
Name Benzenepropanoic acid, .alpha.-butyl-, (R)-
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H18O2
InChI InChI=1S/C13H18O2/c1-2-3-9-12(13(14)15)10-11-7-5-4-6-8-11/h4-8,12H,2-3,9-10H2,1H3,(H,14,15)/t12-/m1/s1
InChIKey NQQBWCDFWBAYBJ-GFCCVEGCSA-N
Molecular Weight 206.285 g/mol
SMILES OC([C@@](Cc1ccccc1)(CCCC)[H])=O
SPLASH splash10-0006-9200000000-3bc9f39eceb1309ae232
Source of Spectrum C-113-3425-0
Synonyms Hydrocinnamic acid, .alpha.-butyl-, (R)-(-)- (2R)-2-benzyl-1-hexanoic acid (2R)-2-benzylhexanoic acid
Wiley ID 1204783