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1-Isobutyl-5-methylindole
SpectraBase Compound ID H1BHnjDWjar
InChI InChI=1S/C13H17N/c1-10(2)9-14-7-6-12-8-11(3)4-5-13(12)14/h4-8,10H,9H2,1-3H3
InChIKey YQJXYEXYUCEIFB-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 JGkQUrfhKVM
Name 1-Isobutyl-5-methylindole
Classification Pharmaceutical drug intermediate
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 187.136099551 u
Formula C13H17N
InChI InChI=1S/C13H17N/c1-10(2)9-14-7-6-12-8-11(3)4-5-13(12)14/h4-8,10H,9H2,1-3H3
InChIKey YQJXYEXYUCEIFB-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 187.286 g/mol
Nominal Mass 187 u
Quality 993
Retention Index 1467
SMILES C1=2C(=CC(=CC2)C)C=CN1CC(C)C
SPLASH splash10-000f-1900000000-6bee320f7c5ba974bf45
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms Indole,1-isobutyl-5-methyl 1-Isobutyl-5-methyl-1H-indole
Technique GC/MS
Wiley ID DD2024_017494