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1H-Indole-3-carboxylic acid, 2-(cyclohexylidenemethyl)-5-methoxy-1-methyl-
SpectraBase Compound ID JEfRWBHfRIk
InChI InChI=1S/C18H21NO3/c1-19-15-9-8-13(22-2)11-14(15)17(18(20)21)16(19)10-12-6-4-3-5-7-12/h8-11H,3-7H2,1-2H3,(H,20,21)
InChIKey ZASGJQBUQIKCRK-UHFFFAOYSA-N
Mol Weight 299.37 g/mol
Molecular Formula C18H21NO3
Exact Mass 299.152144 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 21ZKJSOHGVM
Name 1H-Indole-3-carboxylic acid, 2-(cyclohexylidenemethyl)-5-methoxy-1-methyl-
Alternate Name(s) 2-(cyclohexylidenemethyl)-5-methoxy-1-methyl-1H-indole-3-carboxylic acid 2-(cyclohexylidenemethyl)-5-methoxy-1-methylindole-3-carboxylic acid
CAS Registry Number 122946-86-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H21NO3
InChI InChI=1S/C18H21NO3/c1-19-15-9-8-13(22-2)11-14(15)17(18(20)21)16(19)10-12-6-4-3-5-7-12/h8-11H,3-7H2,1-2H3,(H,20,21)
InChIKey ZASGJQBUQIKCRK-UHFFFAOYSA-N
Molecular Weight 299.370 g/mol
SMILES OC(c1c([n](C)c2c1cc(cc2)OC)C=C1CCCCC1)=O
SPLASH splash10-0udj-0091000000-cabfff84c7b83e0d866f
Source of Spectrum J-54-4793-6
Wiley ID 1302153