SpectraBase Spectrum ID |
DmSgkeoaW00 |
Name |
N-(4-Propylbenzyl)-2-[4-ethyl-2-methoxy-5-methylthiophenyl]ethan-1-amine |
Classification |
Chemical |
Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
357.212635795 u |
Formula |
C22H31NOS |
InChI |
InChI=1S/C22H31NOS/c1-5-7-17-8-10-18(11-9-17)16-23-13-12-20-15-22(25-4)19(6-2)14-21(20)24-3/h8-11,14-15,23H,5-7,12-13,16H2,1-4H3 |
InChIKey |
HUMBNKAVCXASCI-UHFFFAOYSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
357.556 g/mol |
Nominal Mass |
357 u |
Quality |
990 |
Retention Index |
2647 |
SMILES |
C=1(C(=CC(=C(C1)SC)CC)OC)CCNCC=1C=CC(=CC1)CCC |
SPLASH |
splash10-001i-0900000000-89a2107a2062876ac85e |
Source of Spectrum |
DigiLab GmbH (C) 2024 |
Technique |
GC/MS |
Wiley ID |
DD2024_023618 |