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[(1E,3E)-1,3-pentadienylsulfanyl]benzene
SpectraBase Compound ID EYDSlKlLDXa
InChI InChI=1S/C11H12S/c1-2-3-7-10-12-11-8-5-4-6-9-11/h2-10H,1H3/b3-2+,10-7+
InChIKey WDPAZEYBOIKCKT-AWSPGERNSA-N
Mol Weight 176.28 g/mol
Molecular Formula C11H12S
Exact Mass 176.065972 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HAeHDk9RZtR
Name [(1E,3E)-1,3-pentadienylsulfanyl]benzene
Alternate Name(s) [(1E,3E)-penta-1,3-dienyl]sulfanylbenzene [[(1E,3E)-penta-1,3-dienyl]thio]benzene
CAS Registry Number 113108-28-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H12S
InChI InChI=1S/C11H12S/c1-2-3-7-10-12-11-8-5-4-6-9-11/h2-10H,1H3/b3-2+,10-7+
InChIKey WDPAZEYBOIKCKT-AWSPGERNSA-N
Molecular Weight 176.277 g/mol
SMILES C\C=C\C=C\Sc1ccccc1
SPLASH splash10-004j-3900000000-ce1a2550a76826b7d5a8
Source of Spectrum KC-1987-975-74
Wiley ID 1172543