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N-Benzyl-2-(2',3'-dihydro-1',3'-benzothiazole-2'-ylidene)-1-cyclohexanone
SpectraBase Compound ID 5SCIclK3hmn
InChI InChI=1S/C20H19NOS/c22-18-12-6-4-10-16(18)20-21(14-15-8-2-1-3-9-15)17-11-5-7-13-19(17)23-20/h1-3,5,7-9,11,13H,4,6,10,12,14H2/b20-16+
InChIKey ANIVSYCIKNXVGW-CAPFRKAQSA-N
Mol Weight 321.44 g/mol
Molecular Formula C20H19NOS
Exact Mass 321.118735 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1oMeTvPSf5D
Name N-Benzyl-2-(2',3'-dihydro-1',3'-benzothiazole-2'-ylidene)-1-cyclohexanone
Comments Less than 3 mono-isotopic peaks
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Formula C20H19NOS
InChI InChI=1S/C20H19NOS/c22-18-12-6-4-10-16(18)20-21(14-15-8-2-1-3-9-15)17-11-5-7-13-19(17)23-20/h1-3,5,7-9,11,13H,4,6,10,12,14H2/b20-16+
InChIKey ANIVSYCIKNXVGW-CAPFRKAQSA-N
Molecular Weight 321.438 g/mol
SMILES c12N(\C(Sc1cccc2)=C/1C(=O)CCCC1)Cc1ccccc1
SPLASH splash10-0uk9-0097000000-3bbd97bf449264ccc9aa
Source of Spectrum Y-29-1158-12
Synonyms (2E)-2-(3-benzyl-1,3-benzothiazol-2(3H)-ylidene)cyclohexanone
Wiley ID 1321042