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3-(2-Butyl)-2-methylindole
SpectraBase Compound ID 3XtZ1WJ8SPw
InChI InChI=1S/C13H17N/c1-4-9(2)13-10(3)14-12-8-6-5-7-11(12)13/h5-9,14H,4H2,1-3H3
InChIKey LTYDHVRBRZQNFM-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 8FqhRPQXbZw
Name 3-(2-Butyl)-2-methylindole
Classification Pharmaceutical drug precursor
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 187.136099551 u
Formula C13H17N
InChI InChI=1S/C13H17N/c1-4-9(2)13-10(3)14-12-8-6-5-7-11(12)13/h5-9,14H,4H2,1-3H3
InChIKey LTYDHVRBRZQNFM-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 187.286 g/mol
Nominal Mass 187 u
Quality 994
Retention Index 1657
SMILES C=12C(=C(NC2=CC=CC1)C)C(CC)C
SPLASH splash10-0a4i-1900000000-97541ede85ba0ecb4fca
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms Indole,3-(2-butyl)-2-methyl 3-(1-Methylpropyl)-2-methylindole
Technique GC/MS
Wiley ID DD2024_015299