| SpectraBase Spectrum ID |
5W4Wm8c8iwa |
| Name |
3-MT-4-MA N,N-bis-(4-methylbenzyl) |
| Classification |
Chemical |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
419.228285860 u |
| Formula |
C27H33NOS |
| InChI |
InChI=1S/C27H33NOS/c1-20-6-10-23(11-7-20)18-28(19-24-12-8-21(2)9-13-24)22(3)16-25-14-15-26(29-4)27(17-25)30-5/h6-15,17,22H,16,18-19H2,1-5H3 |
| InChIKey |
UDSHRHPXBDRKRR-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
419.627 g/mol |
| Nominal Mass |
419 u |
| Quality |
1000 |
| Retention Index |
3167 |
| SMILES |
C(N(CC1=CC=C(C=C1)C)CC1=CC=C(C=C1)C)(CC=1C=C(C(=CC1)OC)SC)C |
| SPLASH |
splash10-0zfr-1890000000-3e5f545abb64b1fc5201 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
N,N-(4-Methylbenzyl)-1-[4-methoxy-3-methylthiophenyl]-propan-2-amine |
| Technique |
GC/MS |
| Wiley ID |
DD2024_025030 |
