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1-nitro-1-phenylthio-1-pentene
SpectraBase Compound ID EkcsV04Yhew
InChI InChI=1S/C11H13NO2S/c1-2-3-9-11(12(13)14)15-10-7-5-4-6-8-10/h4-9H,2-3H2,1H3/b11-9+
InChIKey ARBJVXITUPFDPB-PKNBQFBNSA-N
Mol Weight 223.29 g/mol
Molecular Formula C11H13NO2S
Exact Mass 223.0667 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8j2RwWDyWvk
Name 1-nitro-1-phenylthio-1-pentene
CAS Registry Number 132364-55-7
Comments Less than 3 mono-isotopic peaks
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Formula C11H13NO2S
InChI InChI=1S/C11H13NO2S/c1-2-3-9-11(12(13)14)15-10-7-5-4-6-8-10/h4-9H,2-3H2,1H3/b11-9+
InChIKey ARBJVXITUPFDPB-PKNBQFBNSA-N
Molecular Weight 223.290 g/mol
SMILES c1(S\C(N(=O)=O)=C/CCC)ccccc1
SPLASH splash10-004i-0940000000-5b5b34da8214db8e1c4f
Source of Spectrum F-46-7436-1
Synonyms (1E)-1-nitro-1-pentenyl phenyl sulfide {[(1E)-1-nitro-1-pentenyl]sulfanyl}benzene
Wiley ID 1223831