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1H-Indole, 1-(11-bromoundecyl)-3-hexyl-
SpectraBase Compound ID L2lFkEEUjdQ
InChI InChI=1S/C25H40BrN/c1-2-3-4-12-17-23-22-27(25-19-14-13-18-24(23)25)21-16-11-9-7-5-6-8-10-15-20-26/h13-14,18-19,22H,2-12,15-17,20-21H2,1H3
InChIKey BQELGDMPRKEFIH-UHFFFAOYSA-N
Mol Weight 434.5 g/mol
Molecular Formula C25H40BrN
Exact Mass 433.234413 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AIlcqNxpzqr
Name 1H-Indole, 1-(11-bromoundecyl)-3-hexyl-
CAS Registry Number 55491-62-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H40BrN
InChI InChI=1S/C25H40BrN/c1-2-3-4-12-17-23-22-27(25-19-14-13-18-24(23)25)21-16-11-9-7-5-6-8-10-15-20-26/h13-14,18-19,22H,2-12,15-17,20-21H2,1H3
InChIKey BQELGDMPRKEFIH-UHFFFAOYSA-N
Molecular Weight 434.506 g/mol
SMILES c1[n](c2c(c1CCCCCC)cccc2)CCCCCCCCCCCBr
SPLASH splash10-03e9-0328900000-de7f831f910bbe6d9173
Source of Spectrum C-97-2495-0
Synonyms 1-(11-bromoundecyl)-3-hexyl-1H-indole 1-(11-Bromoundecyl)-3-hexylindole
Wiley ID 1382703