| SpectraBase Spectrum ID |
8FLDgnNK09Y |
| Name |
3-Me-4-MeO-PEA isothiocyanate |
| Classification |
Phenethylamine designer drug derivative |
| Copyright |
Copyright © 2024-2025 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
207.071785216 u |
| Formula |
C11H13NOS |
| InChI |
InChI=1S/C11H13NOS/c1-9-7-10(5-6-12-8-14)3-4-11(9)13-2/h3-4,7H,5-6H2,1-2H3 |
| InChIKey |
QRWPNVIUNDAHSP-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
207.291 g/mol |
| Nominal Mass |
207 u |
| Quality |
997 |
| Retention Index |
1521 |
| SMILES |
C=1(C(=CC(=CC1)CCN=C=S)C)OC |
| SPLASH |
splash10-000i-2910000000-da17bc69d1c1f48238bd |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
2-(3-Methyl-4-methoxyphenyl)-1-isothiocyanatoethane
4-(2-isothiocyanatoethyl)-1-methoxy-2-methylbenzene |
| Technique |
GC/MS |
| Wiley ID |
DD2024_016935 |
