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1H-Indole, 1-butyl-3-methyl-
SpectraBase Compound ID JYUA9RZ7XgF
InChI InChI=1S/C13H17N/c1-3-4-9-14-10-11(2)12-7-5-6-8-13(12)14/h5-8,10H,3-4,9H2,1-2H3
InChIKey RJCJMSHDEGLHRT-UHFFFAOYSA-N
Mol Weight 187.29 g/mol
Molecular Formula C13H17N
Exact Mass 187.1361 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CpSBz7e6CLO
Name 1H-Indole, 1-butyl-3-methyl-
Alternate Name(s) 1-Butyl-3-methyl-1H-indole 1-Butyl-3-methyl-indole Indole, 1-butyl-3-methyl- 1-nor-butyl-3-methyl-indole 1-Butyl-3-methylindole
CAS Registry Number 1914-00-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H17N
InChI InChI=1S/C13H17N/c1-3-4-9-14-10-11(2)12-7-5-6-8-13(12)14/h5-8,10H,3-4,9H2,1-2H3
InChIKey RJCJMSHDEGLHRT-UHFFFAOYSA-N
Molecular Weight 187.286 g/mol
SMILES CCCC[n]1cc(C)c2ccccc12
SPLASH splash10-0006-1900000000-40a73ab95662d93ca2ab
Source of Spectrum AA-0-1291-2
Wiley ID 20102