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Benzenecarbothioic acid, S-(3-cyano-2-propenyl) ester, (E)-
SpectraBase Compound ID 4RrEYdrXSiA
InChI InChI=1S/C11H9NOS/c12-8-4-5-9-14-11(13)10-6-2-1-3-7-10/h1-7H,9H2/b5-4+
InChIKey JPULUUTXQBONNH-SNAWJCMRSA-N
Mol Weight 203.26 g/mol
Molecular Formula C11H9NOS
Exact Mass 203.040485 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Bw9ro5GBphR
Name Benzenecarbothioic acid, S-(3-cyano-2-propenyl) ester, (E)-
CAS Registry Number 117157-19-4
Comments Less than 3 mono-isotopic peaks
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Formula C11H9NOS
InChI InChI=1S/C11H9NOS/c12-8-4-5-9-14-11(13)10-6-2-1-3-7-10/h1-7H,9H2/b5-4+
InChIKey JPULUUTXQBONNH-SNAWJCMRSA-N
Molecular Weight 203.259 g/mol
SMILES C(#N)\C=C\CSC(=O)c1ccccc1
SPLASH splash10-0a4i-0900000000-b2df651e82d6609e87cd
Source of Spectrum KC-1988-580-5
Synonyms S-3-cyanoprop-2-enyl thiobenzoate(E) S-[(2E)-3-cyano-2-propenyl]benzenecarbothioate
Wiley ID 1200733