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cis/trans-1-Phenylthio-2(E)-propenylcyclopropanecarbonitrile
SpectraBase Compound ID HIssgMZhScK
InChI InChI=1S/C13H13NS/c1-2-6-11-9-13(11,10-14)15-12-7-4-3-5-8-12/h2-8,11H,9H2,1H3/b6-2+
InChIKey GYIOHGWHRYHNER-QHHAFSJGSA-N
Mol Weight 215.31 g/mol
Molecular Formula C13H13NS
Exact Mass 215.076871 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FVAIKQqPvLH
Name cis/trans-1-Phenylthio-2(E)-propenylcyclopropanecarbonitrile
Comments Less than 3 mono-isotopic peaks
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Formula C13H13NS
InChI InChI=1S/C13H13NS/c1-2-6-11-9-13(11,10-14)15-12-7-4-3-5-8-12/h2-8,11H,9H2,1H3/b6-2+
InChIKey GYIOHGWHRYHNER-QHHAFSJGSA-N
Molecular Weight 215.314 g/mol
SMILES C1(C(\C=C\C)C1)(C#N)Sc1ccccc1
SPLASH splash10-03di-0920000000-c2189d9916740cd3153c
Source of Spectrum QA-41-807-4
Synonyms 1-(phenylsulfanyl)-2-[(1E)-1-propenyl]cyclopropanecarbonitrile
Wiley ID 861894