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(E)- and (Z)-.alpha.-acetoxy-.beta.-phenylthiostyrene
SpectraBase Compound ID Ce8NnFMS7lp
InChI InChI=1S/C16H14O2S/c1-13(17)18-12-16(14-8-4-2-5-9-14)19-15-10-6-3-7-11-15/h2-12H,1H3/b16-12+
InChIKey PTQJVCKWXBPGET-FOWTUZBSSA-N
Mol Weight 270.35 g/mol
Molecular Formula C16H14O2S
Exact Mass 270.071451 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FYQ6fTWAXTT
Name (E)- and (Z)-.alpha.-acetoxy-.beta.-phenylthiostyrene
Alternate Name(s) (E)-2-phenyl-2-(phenylsulfanyl)ethenyl acetate
CAS Registry Number 123630-57-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H14O2S
InChI InChI=1S/C16H14O2S/c1-13(17)18-12-16(14-8-4-2-5-9-14)19-15-10-6-3-7-11-15/h2-12H,1H3/b16-12+
InChIKey PTQJVCKWXBPGET-FOWTUZBSSA-N
Molecular Weight 270.346 g/mol
SMILES C(O\C=C/(Sc1ccccc1)c1ccccc1)(=O)C
SPLASH splash10-0a4i-9420000000-e5b370d712a914121e4c
Source of Spectrum KC-1989-1116-2
Wiley ID 1274288