| SpectraBase Spectrum ID |
JJHDx5W0Gjw |
| Name |
Methyl 1-(cyclohexylmethyl)-1H-indole-3-carboxylate |
| Classification |
Designer drug artifact |
| Comments |
Spectrum verified by crosschecking against external libraries (one reference spectrum with similarity >= 99% found) |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
271.157228918 u |
| Formula |
C17H21NO2 |
| InChI |
InChI=1S/C17H21NO2/c1-20-17(19)15-12-18(11-13-7-3-2-4-8-13)16-10-6-5-9-14(15)16/h5-6,9-10,12-13H,2-4,7-8,11H2,1H3 |
| InChIKey |
KNWOMWABRWXHET-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
271.360 g/mol |
| Nominal Mass |
271 u |
| Quality |
954 |
| Retention Index |
2102 |
| SMILES |
C=12C(C(=CN2CC2CCCCC2)C(OC)=O)=CC=CC1 |
| SPLASH |
splash10-0079-1950000000-20f5efe5b4f1fd060785 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
methyl 1-(cyclohexylmethyl)-1H-indole-3-carboxylate |
| Technique |
GC/MS |
| Wiley ID |
DD2024_019615 |
