SpectraBase Spectrum ID |
1cF0lgPUw4 |
Name |
Torasemide-A AC |
Classification |
Pharmaceutical drug derivative |
Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
226.110613078 u |
Formula |
C14H14N2O |
InChI |
InChI=1S/C14H14N2O/c1-11-4-3-5-14(10-11)16(12(2)17)13-6-8-15-9-7-13/h3-10H,1-2H3 |
InChIKey |
FDVMMEQLHSTIRF-UHFFFAOYSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
226.279 g/mol |
Nominal Mass |
226 u |
Quality |
900 |
Retention Index |
2013 |
SMILES |
C=1(N(C2=CC=NC=C2)C(=O)C)C=C(C=CC1)C |
SPLASH |
splash10-000x-9710000000-4b06bb558b375a7875d0 |
Source of Spectrum |
DigiLab GmbH (C) 2024 |
Synonyms |
N,N-(3-Methylphenyl)-(4-pyridyl)acetamide |
Technique |
GC/MS |
Wiley ID |
DD2024_010409 |