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1-Butyl-5-chloroindole
SpectraBase Compound ID J9DnhIfGXCz
InChI InChI=1S/C12H14ClN/c1-2-3-7-14-8-6-10-9-11(13)4-5-12(10)14/h4-6,8-9H,2-3,7H2,1H3
InChIKey DVAOZZBYLWWCGQ-UHFFFAOYSA-N
Mol Weight 207.7 g/mol
Molecular Formula C12H14ClN
Exact Mass 207.081477 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GWbx5uGa5U8
Name 1-Butyl-5-chloroindole
Classification Pharmaceutical drug intermediate
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 207.081477155 u
Formula C12H14ClN
InChI InChI=1S/C12H14ClN/c1-2-3-7-14-8-6-10-9-11(13)4-5-12(10)14/h4-6,8-9H,2-3,7H2,1H3
InChIKey DVAOZZBYLWWCGQ-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 207.704 g/mol
Nominal Mass 207 u
Quality 993
Retention Index 1557
SMILES C1=2C(=CC(=CC2)Cl)C=CN1CCCC
SPLASH splash10-0bt9-3930000000-cfa3247e54038d3af8e4
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms Indole,1-butyl-5-chloro 1-Butyl-5-chloro-1H-indole
Technique GC/MS
Wiley ID DD2024_017211