| SpectraBase Spectrum ID |
2ooc4v8SmiO |
| Name |
1-Benzyl-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 |
337.183049745 u |
| Formula |
C25H23N |
| InChI |
InChI=1S/C25H23N/c1-3-22(21-14-8-5-9-15-21)25-19(2)26(18-20-12-6-4-7-13-20)24-17-11-10-16-23(24)25/h3-17H,18H2,1-2H3/b22-3+ |
| InChIKey |
DOBKWDGZAACAKQ-HEQWTUPCSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
337.466 g/mol |
| Nominal Mass |
337 u |
| Quality |
951 |
| Retention Index |
2748 |
| SMILES |
C=1(C=2C(N(C1C)CC=1C=CC=CC1)=CC=CC2)\C(C1=CC=CC=C1)=C\C |
| SPLASH |
splash10-000l-6589000000-e7a11c031b5ebbc36502 |
| Sample Comments |
cis/trans isomerism uncertain |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
1-Benzyl-2-methyl-3-(1-phenyl-1-propen-1-yl)indole I
1-benzyl-2-methyl-3-(1-phenylprop-1-en-1-yl)-1H-indole |
| Technique |
GC/MS |
| Wiley ID |
DD2024_015366 |
