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Benzeneacetaldehyde, .alpha.-[1-(phenylthio)ethylidene]-, (Z)-
SpectraBase Compound ID Iz4fpWcdqJM
InChI InChI=1S/C16H14OS/c1-13(18-15-10-6-3-7-11-15)16(12-17)14-8-4-2-5-9-14/h2-12H,1H3/b16-13+
InChIKey QVBYDZDMVXCRGL-DTQAZKPQSA-N
Mol Weight 254.35 g/mol
Molecular Formula C16H14OS
Exact Mass 254.076536 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LAJEFkFTF7A
Name Benzeneacetaldehyde, .alpha.-[1-(phenylthio)ethylidene]-, (Z)-
CAS Registry Number 119044-21-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H14OS
InChI InChI=1S/C16H14OS/c1-13(18-15-10-6-3-7-11-15)16(12-17)14-8-4-2-5-9-14/h2-12H,1H3/b16-13+
InChIKey QVBYDZDMVXCRGL-DTQAZKPQSA-N
Molecular Weight 254.347 g/mol
SMILES c1(S\C(=C\(c2ccccc2)C=O)C)ccccc1
SPLASH splash10-02t9-0920000000-d08dad82809eadbad134
Source of Spectrum F-44-4466-0
Synonyms (2Z)-2-phenyl-3-(phenylsulfanyl)-2-butenal (Z)-2-Phenyl-3-phenylthiobut-2-enal
Wiley ID 1258019