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Benzene, [(1-methylene-2-butenyl)thio]-, (E)-
SpectraBase Compound ID CagVdHDO1cO
InChI InChI=1S/C11H12S/c1-3-7-10(2)12-11-8-5-4-6-9-11/h3-9H,2H2,1H3/b7-3+
InChIKey LJVFKCVWQMAOEG-XVNBXDOJSA-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 E3W6pRtzXG3
Name Benzene, [(1-methylene-2-butenyl)thio]-, (E)-
CAS Registry Number 110026-94-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H12S
InChI InChI=1S/C11H12S/c1-3-7-10(2)12-11-8-5-4-6-9-11/h3-9H,2H2,1H3/b7-3+
InChIKey LJVFKCVWQMAOEG-XVNBXDOJSA-N
Molecular Weight 176.277 g/mol
SMILES C(Sc1ccccc1)(\C=C\C)=C
SPLASH splash10-03fs-0900000000-80e6167f53b37d6ee45b
Source of Spectrum J-52-4470-4
Synonyms (2E)-1-methylene-2-butenyl phenyl sulfide (E)-2-(phenylthio)-1,3-pentadiene {[(2E)-1-methylene-2-butenyl]sulfanyl}benzene [[(3E)-penta-1,3-dien-2-yl]thio]benzene [(E)-1-methylenebut-2-enyl]sulfanylbenzene [(3E)-penta-1,3-dien-2-yl]sulfanylbenzene
Wiley ID 1172537