| SpectraBase Spectrum ID |
JJ2FjBVRNPU |
| Name |
1-(2-Methylbutyl)-2-methyl-3-(1-phenyl-1-propen-1-yl)-1H-indole I |
| Classification |
Indole cannabinoid side product |
| Comments |
Spectrum verified by independent measurements in external laboratories |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
317.214349873 u |
| Formula |
C23H27N |
| InChI |
InChI=1S/C23H27N/c1-5-17(3)16-24-18(4)23(21-14-10-11-15-22(21)24)20(6-2)19-12-8-7-9-13-19/h6-15,17H,5,16H2,1-4H3/b20-6+ |
| InChIKey |
XYLNPXXQLCMNTI-CGOBSMCZSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
317.476 g/mol |
| Nominal Mass |
317 u |
| Quality |
986 |
| Retention Index |
2426 |
| SMILES |
C=1(\C(C=2C=CC=CC2)=C\C)C=2C(N(C1C)CC(CC)C)=CC=CC2 |
| SPLASH |
splash10-02ar-2592000000-fa2f66688b9269d8593d |
| Sample Comments |
cis/trans isomerism uncertain |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
1-(2-Methylbutyl)-2-methyl-3-(1-phenyl-1-propen-1-yl)indole I
2-methyl-1-(2-methylbutyl)-3-(1-phenylprop-1-en-1-yl)-1H-indole |
| Technique |
GC/MS |
| Wiley ID |
DD2024_015386 |
