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Torasemide artifact 2ME
SpectraBase Compound ID KfwIrZcAJYd
InChI InChI=1S/C14H17N3O2S/c1-11-6-4-7-12(10-11)16-13-8-5-9-15-14(13)20(18,19)17(2)3/h4-10,16H,1-3H3
InChIKey NYEMBHWEYYVMOC-UHFFFAOYSA-N
Mol Weight 291.37 g/mol
Molecular Formula C14H17N3O2S
Exact Mass 291.104148 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FtHwNXvIoe4
Name Torasemide artifact 2ME
Classification Diuretic
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Exact Mass 291.104147971 u
Formula C14H17N3O2S
InChI InChI=1S/C14H17N3O2S/c1-11-6-4-7-12(10-11)16-13-8-5-9-15-14(13)20(18,19)17(2)3/h4-10,16H,1-3H3
InChIKey NYEMBHWEYYVMOC-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 291.369 g/mol
SMILES c1c(cc(cc1)C)Nc1c(nccc1)S(N(C)C)(=O)=O
SPLASH splash10-001i-1920000000-5d135b7e83785794d440
Sample Comments The MMPW Reference Handbook and associated Tables are attached to Record #1, under the Attachments tab. Refer to these references for an explanation of the Sample Preparation Procedure "Detected" abbreviations, as well as other relevant information pertaining to this database.
Sample Preparation Procedure Detected: P
Source of Spectrum H.H.Maurer, M.Meyer, K.Pfleger, A.A. Weber / University of Saarland, D-66424 Homburg Germany
Technique GC/MS
Wiley ID MMPW6e_7333