| SpectraBase Spectrum ID |
8FKmWgv1iGe |
| Name |
5-TOET (N-4-methylbenzoyl |
| Classification |
Chemical |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
357.176250285 u |
| Formula |
C21H27NO2S |
| InChI |
InChI=1S/C21H27NO2S/c1-6-16-12-19(24-4)18(13-20(16)25-5)11-15(3)22-21(23)17-9-7-14(2)8-10-17/h7-10,12-13,15H,6,11H2,1-5H3,(H,22,23) |
| InChIKey |
ZDCZOZUSSKVXHW-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
357.512 g/mol |
| Nominal Mass |
357 u |
| Quality |
999 |
| Retention Index |
2794 |
| SMILES |
C1(=C(C=C(C(=C1)SC)CC)OC)CC(NC(C=1C=CC(=CC1)C)=O)C |
| SPLASH |
splash10-01b9-2952000000-61e5043f3d3d15d4178d |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
N-(1-[4-Ethyl-2-methoxy-5-methylthiophenyl]propan-2-yl)-4-methylbenzamide |
| Technique |
GC/MS |
| Wiley ID |
DD2024_025025 |
