| SpectraBase Spectrum ID |
5VDFCEQ7unQ |
| Name |
1-(2-Butyl)-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 |
303.198699809 u |
| Formula |
C22H25N |
| InChI |
InChI=1S/C22H25N/c1-5-16(3)23-17(4)22(20-14-10-11-15-21(20)23)19(6-2)18-12-8-7-9-13-18/h6-16H,5H2,1-4H3/b19-6+ |
| InChIKey |
VRPIHUZVTMSSFN-KPSZGOFPSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
303.449 g/mol |
| Nominal Mass |
303 u |
| Quality |
982 |
| Retention Index |
2300 |
| SMILES |
C=1(C=2C(N(C1C)C(CC)C)=CC=CC2)\C(C=1C=CC=CC1)=C\C |
| SPLASH |
splash10-0uxr-1493000000-98703ff679e2eb6b1095 |
| Sample Comments |
cis/trans isomerism uncertain |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
1-(2-Butyl)-2-methyl-3-(1-phenyl-1-propen-1-yl)indole I
1-(butan-2-yl)-2-methyl-3-(1-phenylprop-1-en-1-yl)-1H-indole |
| Technique |
GC/MS |
| Wiley ID |
DD2024_015374 |
