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Rosiglitazone
SpectraBase Compound ID BfYlR25LHkN
InChI InChI=1S/C18H19N3O3S/c1-21(16-4-2-3-9-19-16)10-11-24-14-7-5-13(6-8-14)12-15-17(22)20-18(23)25-15/h2-9,15H,10-12H2,1H3,(H,20,22,23)
InChIKey YASAKCUCGLMORW-UHFFFAOYSA-N
Mol Weight 357.43 g/mol
Molecular Formula C18H19N3O3S
Exact Mass 357.114713 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID sNxCaCdaC
Name Rosiglitazone
CAS Registry Number 122320-73-4
Classification Antidiabetic
Copyright Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 357.114712655 u
Formula C18H19N3O3S
InChI InChI=1S/C18H19N3O3S/c1-21(16-4-2-3-9-19-16)10-11-24-14-7-5-13(6-8-14)12-15-17(22)20-18(23)25-15/h2-9,15H,10-12H2,1H3,(H,20,22,23)
InChIKey YASAKCUCGLMORW-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 357.428 g/mol
SMILES c1cc(OCCN(C)c2ncccc2)ccc1CC1SC(=O)NC1=O
SPLASH splash10-00di-5910000000-df8cade24eebc121e51f
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.
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_7726