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2-Buten-2-ol, 3-(phenylthio)-, acetate, (E)-
SpectraBase Compound ID CLoR9hNWgT6
InChI InChI=1S/C12H14O2S/c1-9(14-11(3)13)10(2)15-12-7-5-4-6-8-12/h4-8H,1-3H3/b10-9+
InChIKey YUDMYNNZOFUFSF-MDZDMXLPSA-N
Mol Weight 222.3 g/mol
Molecular Formula C12H14O2S
Exact Mass 222.071451 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7hesnmENMRG
Name 2-Buten-2-ol, 3-(phenylthio)-, acetate, (E)-
CAS Registry Number 123630-50-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H14O2S
InChI InChI=1S/C12H14O2S/c1-9(14-11(3)13)10(2)15-12-7-5-4-6-8-12/h4-8H,1-3H3/b10-9+
InChIKey YUDMYNNZOFUFSF-MDZDMXLPSA-N
Molecular Weight 222.302 g/mol
SMILES C(O\C(=C/(Sc1ccccc1)C)C)(=O)C
SPLASH splash10-052f-9300000000-8e07c2c883c6ca9166df
Source of Spectrum KC-1989-1116-2
Synonyms (1E)-1-methyl-2-(phenylsulfanyl)-1-propenyl acetate (E)-2-Acetoxy-3-phenylthiobut-2-ene
Wiley ID 1222150