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Torasemide-A AC
SpectraBase Compound ID Fz3JsHE8oU8
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
Mol Weight 226.28 g/mol
Molecular Formula C14H14N2O
Exact Mass 226.110613 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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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