| SpectraBase Spectrum ID |
5XZNS4MrRmy |
| Name |
5-TOET N-(4-methylbenzyl) |
| Classification |
Chemical |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
343.196985731 u |
| Formula |
C21H29NOS |
| InChI |
InChI=1S/C21H29NOS/c1-6-18-12-20(23-4)19(13-21(18)24-5)11-16(3)22-14-17-9-7-15(2)8-10-17/h7-10,12-13,16,22H,6,11,14H2,1-5H3 |
| InChIKey |
RAYIIUXNHGNFGZ-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
343.529 g/mol |
| Nominal Mass |
343 u |
| Quality |
1000 |
| Retention Index |
2537 |
| SMILES |
C1(=C(C=C(C(=C1)SC)CC)OC)CC(NCC=1C=CC(=CC1)C)C |
| SPLASH |
splash10-052b-0900000000-b86466a1bb7433b77d08 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
1-[4-Ethyl-2-methoxy-5-methylthiophenyl]-N-(4-methylbenzyl)propan-2-amine |
| Technique |
GC/MS |
| Wiley ID |
DD2024_025024 |
