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1H-Indole-3-carboxylic acid, 2-(2,2-diphenylethenyl)-5-methoxy-1-methyl-
SpectraBase Compound ID CjOCWi9Qq8F
InChI InChI=1S/C25H21NO3/c1-26-22-14-13-19(29-2)15-21(22)24(25(27)28)23(26)16-20(17-9-5-3-6-10-17)18-11-7-4-8-12-18/h3-16H,1-2H3,(H,27,28)
InChIKey LTBZCAPHVIQYHV-UHFFFAOYSA-N
Mol Weight 383.45 g/mol
Molecular Formula C25H21NO3
Exact Mass 383.152144 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 19pCRNwkJmz
Name 1H-Indole-3-carboxylic acid, 2-(2,2-diphenylethenyl)-5-methoxy-1-methyl-
Alternate Name(s) 2-(2,2-diphenylvinyl)-5-methoxy-1-methyl-1H-indole-3-carboxylic acid 5-Methoxy-1-methyl-2-(2,2-diphenylethenyl)indole-3-carboxylic acid
CAS Registry Number 122946-88-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H21NO3
InChI InChI=1S/C25H21NO3/c1-26-22-14-13-19(29-2)15-21(22)24(25(27)28)23(26)16-20(17-9-5-3-6-10-17)18-11-7-4-8-12-18/h3-16H,1-2H3,(H,27,28)
InChIKey LTBZCAPHVIQYHV-UHFFFAOYSA-N
Molecular Weight 383.447 g/mol
SMILES OC(c1c([n](c2ccc(cc12)OC)C)C=C(c1ccccc1)c1ccccc1)=O
SPLASH splash10-0019-0009000000-dd26ef026c6c3b56dbf1
Source of Spectrum J-54-4791-6
Wiley ID 1361178