| SpectraBase Spectrum ID |
Ajzj3ij4G35 |
| Name |
1-Butyl-2-methyl-3-(1-phenyl-1-propen-1-yl)-1H-indole II |
| Classification |
Indole cannabinoid side product |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
303.198699809 u |
| Formula |
C22H25N |
| InChI |
InChI=1S/C22H25N/c1-4-6-16-23-17(3)22(20-14-10-11-15-21(20)23)19(5-2)18-12-8-7-9-13-18/h5,7-15H,4,6,16H2,1-3H3/b19-5+ |
| InChIKey |
JKTKTZCTFRGSKE-PTXOJBNSSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
303.449 g/mol |
| Nominal Mass |
303 u |
| Quality |
995 |
| Retention Index |
2430 |
| SMILES |
C=1(C=2C(N(C1C)CCCC)=CC=CC2)\C(C=1C=CC=CC1)=C\C |
| SPLASH |
splash10-0uk9-1493000000-22d0c0937b75868f8d74 |
| Sample Comments |
cis/trans isomerism uncertain |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
1-Butyl-2-methyl-3-(1-phenyl-1-propen-1-yl)indole II
1-butyl-2-methyl-3-(1-phenylprop-1-en-1-yl)-1H-indole |
| Technique |
GC/MS |
| Wiley ID |
DD2024_015362 |
