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1-iso-Butyl-2-methyl-3-(1-naphthyl-1-propen-1-yl)-1H-indole II
SpectraBase Compound ID 7df4X5qMmyV
InChI InChI=1S/C26H27N/c1-5-21(23-15-10-12-20-11-6-7-13-22(20)23)26-19(4)27(17-18(2)3)25-16-9-8-14-24(25)26/h5-16,18H,17H2,1-4H3/b21-5+
InChIKey OUUFHTJXRGTKDL-IGCPIRJNSA-N
Mol Weight 353.51 g/mol
Molecular Formula C26H27N
Exact Mass 353.21435 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9vElQthGdKA
Name 1-iso-Butyl-2-methyl-3-(1-naphthyl-1-propen-1-yl)-1H-indole I
Classification Indole cannabinoid side product
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 353.214349873 u
Formula C26H27N
InChI InChI=1S/C26H27N/c1-5-21(23-15-10-12-20-11-6-7-13-22(20)23)26-19(4)27(17-18(2)3)25-16-9-8-14-24(25)26/h5-16,18H,17H2,1-4H3/b21-5+
InChIKey OUUFHTJXRGTKDL-IGCPIRJNSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 353.509 g/mol
Nominal Mass 353 u
Quality 972
Retention Index 2830
SMILES C=1(\C(C=2C3=C(C=CC2)C=CC=C3)=C\C)C=2C(N(C1C)CC(C)C)=CC=CC2
SPLASH splash10-0uk9-1659000000-e7dee739834640b9ba38
Sample Comments cis/trans isomerism uncertain
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms 2-methyl-1-(2-methylpropyl)-3-(1-(naphthalen-1-yl)prop-1-en-1-yl)-1H-indole
Technique GC/MS
Wiley ID DD2024_015887