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1-Propen-1-ol, 2-(phenylthio)-, acetate, (E)-
SpectraBase Compound ID ICBbaVTEvlW
InChI InChI=1S/C11H12O2S/c1-9(8-13-10(2)12)14-11-6-4-3-5-7-11/h3-8H,1-2H3/b9-8+
InChIKey JXYVXLMUYXCOGM-CMDGGOBGSA-N
Mol Weight 208.27 g/mol
Molecular Formula C11H12O2S
Exact Mass 208.055801 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AHewoDffR5e
Name 1-Propen-1-ol, 2-(phenylthio)-, acetate, (E)-
CAS Registry Number 123630-42-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H12O2S
InChI InChI=1S/C11H12O2S/c1-9(8-13-10(2)12)14-11-6-4-3-5-7-11/h3-8H,1-2H3/b9-8+
InChIKey JXYVXLMUYXCOGM-CMDGGOBGSA-N
Molecular Weight 208.275 g/mol
SMILES c1(S\C(=C\OC(=O)C)C)ccccc1
SPLASH splash10-0aor-8910000000-39615e777738a7399e95
Source of Spectrum KC-1989-1115-2
Synonyms (1E)-2-(phenylsulfanyl)-1-propenyl acetate (E)-1-Acetoxy-2-phenylthiopropene
Wiley ID 1206492