| SpectraBase Spectrum ID |
JGusGsQGxiC |
| Name |
2-Thiothinone-A (-2H) |
| Classification |
Designer drug artifact |
| Comments |
Spectrum verified by independent measurements in external laboratories |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
167.040485087 u |
| Formula |
C8H9NOS |
| InChI |
InChI=1S/C8H9NOS/c1-6(9-2)8(10)7-4-3-5-11-7/h3-5,9H,1H2,2H3 |
| InChIKey |
QIRPWHVKHNVVOJ-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
167.226 g/mol |
| Nominal Mass |
167 u |
| Quality |
990 |
| Retention Index |
1361 |
| SMILES |
C(C=1SC=CC1)(C(NC)=C)=O |
| SPLASH |
splash10-0a4i-9000000000-60b10d8e5b485526c2c0 |
| Sample Comments |
Position of pi-bond uncertain |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
MTP-A (-2H)
2-(Methylamino)-1-(thiophen-2-yl)prop-2-en-1-one |
| Technique |
GC/MS |
| Wiley ID |
DD2024_029168 |
