| SpectraBase Spectrum ID |
5YVBiNwaZQ8 |
| Name |
1-Allyl-2-methyl-3-(1-phenyl-1-propen-1-yl)-1H-indole I |
| Classification |
Indole cannabinoid side product |
| Copyright |
Copyright © 2024-2025 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
287.167399680 u |
| Formula |
C21H21N |
| InChI |
InChI=1S/C21H21N/c1-4-15-22-16(3)21(19-13-9-10-14-20(19)22)18(5-2)17-11-7-6-8-12-17/h4-14H,1,15H2,2-3H3/b18-5+ |
| InChIKey |
GXEQMZCUFVZAPQ-BLLMUTORSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
287.406 g/mol |
| Nominal Mass |
287 u |
| Quality |
941 |
| Retention Index |
2270 |
| SMILES |
C=1(\C(C2=CC=CC=C2)=C\C)C=2C(N(C1C)CC=C)=CC=CC2 |
| SPLASH |
splash10-05n0-1390000000-e4bde4063d45329e6f3c |
| Sample Comments |
cis/trans isomerism uncertain |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
1-Allyl-2-methyl-3-(1-phenyl-1-propen-1-yl)indole I
2-methyl-3-(1-phenylprop-1-en-1-yl)-1-(prop-2-en-1-yl)-1H-indole |
| Technique |
GC/MS |
| Wiley ID |
DD2024_015378 |
