| SpectraBase Spectrum ID |
8G0PF6OmAkq |
| Name |
1-Hexyl-2-methyl-3-(1-phenyl-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 |
331.229999938 u |
| Formula |
C24H29N |
| InChI |
InChI=1S/C24H29N/c1-4-6-7-13-18-25-19(3)24(22-16-11-12-17-23(22)25)21(5-2)20-14-9-8-10-15-20/h5,8-12,14-17H,4,6-7,13,18H2,1-3H3/b21-5+ |
| InChIKey |
OWNHFQWYHAPFDB-IGCPIRJNSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
331.503 g/mol |
| Nominal Mass |
331 u |
| Quality |
994 |
| Retention Index |
2555 |
| SMILES |
C=1(\C(C=2C=CC=CC2)=C\C)C=2C(N(C1C)CCCCCC)=CC=CC2 |
| SPLASH |
splash10-001i-1589000000-ce7449b2784e5220ae33 |
| Sample Comments |
cis/trans isomerism uncertain |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
1-Hexyl-2-methyl-3-(1-phenyl-1-propen-1-yl)indole I
1-hexyl-2-methyl-3-(1-phenylprop-1-en-1-yl)-1H-indole |
| Technique |
GC/MS |
| Wiley ID |
DD2024_015364 |
