| SpectraBase Spectrum ID |
Dm3OTqAQmNU |
| Name |
3-THAP m-toluoyl |
| Classification |
Aminoethylthiophene designer drug |
| Comments |
Spectrum verified by independent measurements in external laboratories |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
259.103085344 u |
| Formula |
C15H17NOS |
| InChI |
InChI=1S/C15H17NOS/c1-11-4-3-5-14(8-11)15(17)16-12(2)9-13-6-7-18-10-13/h3-8,10,12H,9H2,1-2H3,(H,16,17) |
| InChIKey |
LVRQKOITUDMAPL-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
259.367 g/mol |
| Nominal Mass |
259 u |
| Quality |
991 |
| Retention Index |
2295 |
| SMILES |
C(C=1C=C(C=CC1)C)(NC(CC1=CSC=C1)C)=O |
| SPLASH |
splash10-014i-3900000000-75567d4370642ae466a5 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
3-Methyl-N-[1-(thiophen-3-yl)propan-2-yl]benzamide |
| Technique |
GC/MS |
| Wiley ID |
DD2024_023712 |
