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3-Pentenoic acid, 2,4-dimethyl-, 2-phenylethyl ester, (S)-
SpectraBase Compound ID 1Ig7wdIUeVm
InChI InChI=1S/C15H20O2/c1-12(2)11-13(3)15(16)17-10-9-14-7-5-4-6-8-14/h4-8,11,13H,9-10H2,1-3H3/t13-/m0/s1
InChIKey BJMVIQUGYUGACV-ZDUSSCGKSA-N
Mol Weight 232.32 g/mol
Molecular Formula C15H20O2
Exact Mass 232.14633 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2ZaRG5bgt8S
Name 3-Pentenoic acid, 2,4-dimethyl-, 2-phenylethyl ester, (S)-
Alternate Name(s) 2-Phenylethyl (2S)-2,4-dimethyl-3-pentenoate Phenylethyl 2,4-diemthyl-3-pentenoate
CAS Registry Number 108584-79-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H20O2
InChI InChI=1S/C15H20O2/c1-12(2)11-13(3)15(16)17-10-9-14-7-5-4-6-8-14/h4-8,11,13H,9-10H2,1-3H3/t13-/m0/s1
InChIKey BJMVIQUGYUGACV-ZDUSSCGKSA-N
Molecular Weight 232.323 g/mol
SMILES C([C@@](C(=O)OCCc1ccccc1)(C)[H])=C(C)C
SPLASH splash10-0zgi-4900000000-dae6772a110a226520aa
Source of Spectrum F-45-6190-23
Wiley ID 1234194