| SpectraBase Spectrum ID |
2pPM1NTc9K4 |
| Name |
Methyl 3-amino-4-methyl-2-thiophenecarboxylate |
| CAS Registry Number |
85006-31-1 |
| Classification |
Chemical |
| Copyright |
Copyright © 2024-2025 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
171.035399706 u |
| Formula |
C7H9NO2S |
| InChI |
InChI=1S/C7H9NO2S/c1-4-3-11-6(5(4)8)7(9)10-2/h3H,8H2,1-2H3 |
| InChIKey |
YICRPERKKBDRSP-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
171.214 g/mol |
| Nominal Mass |
171 u |
| Quality |
902 |
| Retention Index |
1246 |
| SMILES |
NC1=C(C(OC)=O)SC=C1C |
| SPLASH |
splash10-01w0-3900000000-a8f50d2c1a82529eeb62 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
methyl 3-amino-4-methylthiophene-2-carboxylate |
| Technique |
GC/MS |
| Wiley ID |
DD2024_021638 |
