| SpectraBase Spectrum ID |
JENghHk7RHk |
| Name |
Amisulpride-M (Nor) |
| Classification |
Pharmaceutical drug metabolite |
| Comments |
Spectrum verified by crosschecking against external libraries (one reference spectrum with similarity >= 99% found) |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
355.156577467 u |
| Formula |
C16H25N3O4S |
| InChI |
InChI=1S/C16H25N3O4S/c1-3-19-7-5-6-11(19)10-18-16(21)12-8-15(24(22,23)4-2)13(17)9-14(12)20/h8-9,11,20H,3-7,10,17H2,1-2H3,(H,18,21) |
| InChIKey |
XBIBUXBARDPHCJ-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
355.453 g/mol |
| Nominal Mass |
355 u |
| Quality |
926 |
| Retention Index |
2764 |
| SMILES |
NC1=C(C=C(C(=C1)O)C(NCC1N(CCC1)CC)=O)S(CC)(=O)=O |
| SPLASH |
splash10-0002-9100000000-b77f0864a6821b299caf |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
4-amino-N-((1-ethylpyrrolidin-2-yl)methyl)-5-(ethylsulfonyl)-2-hydroxybenzamide |
| Technique |
GC/MS |
| Wiley ID |
DD2024_005953 |
