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2-[N,N-Dimethyl-1'-carbamoyl-1'-(4"'-tolyl)methylidene]-7-methyl-3-(2"-tolyl)imino-1H-indole
SpectraBase Compound ID BfmRdURoJTp
InChI InChI=1S/C27H27N3O/c1-17-13-15-20(16-14-17)23(27(31)30(4)5)26-25(28-22-12-7-6-9-18(22)2)21-11-8-10-19(3)24(21)29-26/h6-16,29H,1-5H3/b26-23+,28-25+
InChIKey KKOZIFSGBHVVOX-AXWXSEEYSA-N
Mol Weight 409.53 g/mol
Molecular Formula C27H27N3O
Exact Mass 409.215413 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3I0Jo7QMsHp
Name 2-[N,N-Dimethyl-1'-carbamoyl-1'-(4"'-tolyl)methylidene]-7-methyl-3-(2"-tolyl)imino-1H-indole
Alternate Name(s) (2E)-N,N-dimethyl-2-{(3E)-7-methyl-3-[(2-methylphenyl)imino]-1,3-dihydro-2H-indol-2-ylidene}-2-(4-methylphenyl)ethanamide 2-[N,N-Dimethyl-1'-carbamoyl-1'-(4'''-tolyl)methylidene]-7-methyl-3-(2''-tolyl)imino-1H-indole
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Formula C27H27N3O
InChI InChI=1S/C27H27N3O/c1-17-13-15-20(16-14-17)23(27(31)30(4)5)26-25(28-22-12-7-6-9-18(22)2)21-11-8-10-19(3)24(21)29-26/h6-16,29H,1-5H3/b26-23+,28-25+
InChIKey KKOZIFSGBHVVOX-AXWXSEEYSA-N
Molecular Weight 409.533 g/mol
SMILES N1c2c(cccc2\C(\C1=C\(C(N(C)C)=O)c1ccc(cc1)C)=N\c1c(C)cccc1)C
SPLASH splash10-0a4i-0002900000-9a0ca290e41efe23b4d9
Source of Spectrum U1-2001-3958-5
Wiley ID 815087