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1-Benzylthio-4-(thiobenzoyloxy)but-1-ene
SpectraBase Compound ID 1B6cV22tB2h
InChI InChI=1S/C18H18OS2/c20-18(17-11-5-2-6-12-17)19-13-7-8-14-21-15-16-9-3-1-4-10-16/h1-6,8-12,14H,7,13,15H2/b14-8+
InChIKey NMJUUWXNGCSWAY-RIYZIHGNSA-N
Mol Weight 314.46 g/mol
Molecular Formula C18H18OS2
Exact Mass 314.079908 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GS3dXrce8DJ
Name 1-Benzylthio-4-(thiobenzoyloxy)but-1-ene
Alternate Name(s) O-[(3E)-4-(benzylsulfanyl)-3-butenyl]benzenecarbothioate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H18OS2
InChI InChI=1S/C18H18OS2/c20-18(17-11-5-2-6-12-17)19-13-7-8-14-21-15-16-9-3-1-4-10-16/h1-6,8-12,14H,7,13,15H2/b14-8+
InChIKey NMJUUWXNGCSWAY-RIYZIHGNSA-N
Molecular Weight 314.461 g/mol
SMILES C(\C=C\SCc1ccccc1)COC(c1ccccc1)=S
SPLASH splash10-054x-9200000000-147ac66ee69b66795b5b
Source of Spectrum F-54-8213-9
Wiley ID 807803