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5-Chloro-1-hexylindole
SpectraBase Compound ID KpFC7fZt2z6
InChI InChI=1S/C14H18ClN/c1-2-3-4-5-9-16-10-8-12-11-13(15)6-7-14(12)16/h6-8,10-11H,2-5,9H2,1H3
InChIKey AAOMCHBZHWAGOY-UHFFFAOYSA-N
Mol Weight 235.76 g/mol
Molecular Formula C14H18ClN
Exact Mass 235.112777 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8IPl0OWdtOC
Name 5-Chloro-1-hexylindole
Classification Pharmaceutical drug intermediate
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 235.112777284 u
Formula C14H18ClN
InChI InChI=1S/C14H18ClN/c1-2-3-4-5-9-16-10-8-12-11-13(15)6-7-14(12)16/h6-8,10-11H,2-5,9H2,1H3
InChIKey AAOMCHBZHWAGOY-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 235.758 g/mol
Nominal Mass 235 u
Quality 971
Retention Index 1954
SMILES C=12C(N(C=C2)CCCCCC)=CC=C(C1)Cl
SPLASH splash10-0409-2920000000-7c7c285b8b256b8447b3
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms Indole,5-chloro-1-hexyl 5-Chloro-1-hexyl-1H-indole
Technique GC/MS
Wiley ID DD2024_017213