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(2R)-2-[(S)-hydroxy(o-tolyl)methyl]pent-4-enoic acid methyl ester
SpectraBase Compound ID 3wPxyaKYgyp
InChI InChI=1S/C14H18O3/c1-4-7-12(14(16)17-3)13(15)11-9-6-5-8-10(11)2/h4-6,8-9,12-13,15H,1,7H2,2-3H3/t12-,13-/m1/s1
InChIKey MEZCYMYPSLGMCJ-CHWSQXEVSA-N
Mol Weight 234.29 g/mol
Molecular Formula C14H18O3
Exact Mass 234.125594 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1RNFF6AqeG
Name (2R)-2-[(S)-hydroxy(o-tolyl)methyl]pent-4-enoic acid methyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H18O3
InChI InChI=1S/C14H18O3/c1-4-7-12(14(16)17-3)13(15)11-9-6-5-8-10(11)2/h4-6,8-9,12-13,15H,1,7H2,2-3H3/t12-,13-/m1/s1
InChIKey MEZCYMYPSLGMCJ-CHWSQXEVSA-N
Molecular Weight 234.295 g/mol
SMILES O[C@@]([C@](C(=O)OC)(CC=C)[H])(c1c(C)cccc1)[H]
SPLASH splash10-022c-2900000000-7e017da94aa6bd2ab1a6
Source of Spectrum F-62-929-10
Synonyms (2R)-2-[(S)-hydroxy-(2-methylphenyl)methyl]-4-pentenoic acid methyl ester Methyl (2R)-2-[(S)-(2-methylphenyl)-oxidanyl-methyl]pent-4-enoate Methyl (2R)-2-[(S)-hydroxy(o-tolyl)methyl]pent-4-enoate Methyl (2R)-2-[(S)-hydroxy-(2-methylphenyl)methyl]pent-4-enoate
Wiley ID 1632052