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2-Pentenoic acid, 4-(phenylthio)-, butyl ester, (E)-

View entire compound with spectra: 1 MS (GC)

2-Pentenoic acid, 4-(phenylthio)-, butyl ester, (E)-
SpectraBase Compound ID 7w59xw6cYLf
InChI InChI=1S/C15H20O2S/c1-3-4-12-17-15(16)11-10-13(2)18-14-8-6-5-7-9-14/h5-11,13H,3-4,12H2,1-2H3/b11-10+
InChIKey ZLJCXANLAMTQMM-ZHACJKMWSA-N
Mol Weight 264.38 g/mol
Molecular Formula C15H20O2S
Exact Mass 264.118401 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4U7kVQtnaYa
Name 2-Pentenoic acid, 4-(phenylthio)-, butyl ester, (E)-
CAS Registry Number 88087-86-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H20O2S
InChI InChI=1S/C15H20O2S/c1-3-4-12-17-15(16)11-10-13(2)18-14-8-6-5-7-9-14/h5-11,13H,3-4,12H2,1-2H3/b11-10+
InChIKey ZLJCXANLAMTQMM-ZHACJKMWSA-N
Molecular Weight 264.383 g/mol
SMILES C(\C=C\C(Sc1ccccc1)C)(=O)OCCCC
SPLASH splash10-03di-4940000000-5ba7fbd4f15bf03e80f4
Source of Spectrum KC-1986-1703-65
Wiley ID 1267898