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1-Butyl-3-(1-(4-ethylphenyl)-1-propen-1-yl)-2-methyl-1H-indole II
SpectraBase Compound ID GGCYKHCtY4N
InChI InChI=1S/C24H29N/c1-5-8-17-25-18(4)24(22-11-9-10-12-23(22)25)21(7-3)20-15-13-19(6-2)14-16-20/h7,9-16H,5-6,8,17H2,1-4H3/b21-7+
InChIKey XIACCEWUOSZMSH-QPSGOUHRSA-N
Mol Weight 331.5 g/mol
Molecular Formula C24H29N
Exact Mass 331.23 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HYd3okZo5jM
Name 1-Butyl-3-(1-(4-ethylphenyl)-1-propen-1-yl)-2-methyl-1H-indole II
Classification Indole cannabinoid side product
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 331.229999938 u
Formula C24H29N
InChI InChI=1S/C24H29N/c1-5-8-17-25-18(4)24(22-11-9-10-12-23(22)25)21(7-3)20-15-13-19(6-2)14-16-20/h7,9-16H,5-6,8,17H2,1-4H3/b21-7+
InChIKey XIACCEWUOSZMSH-QPSGOUHRSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 331.503 g/mol
Nominal Mass 331 u
Quality 956
Retention Index 2584
SMILES C=1(C=2C(N(C1C)CCCC)=CC=CC2)\C(C1=CC=C(C=C1)CC)=C\C
SPLASH splash10-0f89-0259000000-4c7656dd414b85bd6af3
Sample Comments cis/trans isomerism uncertain
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms 1-Butyl-3-(1-(4-ethylphenyl)-1-propen-1-yl)-2-methylindole II 1-butyl-3-(1-(4-ethylphenyl)prop-1-en-1-yl)-2-methyl-1H-indole
Technique GC/MS
Wiley ID DD2024_015633