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Niflumic acid-M (di-HO-) 3ME
SpectraBase Compound ID BCSddxZIZQP
InChI InChI=1S/C16H15F3N2O4/c1-23-10-7-11(15(22)25-3)14(20-8-10)21-9-4-5-13(24-2)12(6-9)16(17,18)19/h4-8H,1-3H3,(H,20,21)
InChIKey DJCQEGXXKGPCEL-UHFFFAOYSA-N
Mol Weight 356.3 g/mol
Molecular Formula C16H15F3N2O4
Exact Mass 356.098391 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JIicq8z0TfO
Name Niflumic acid-M (di-HO-) 3ME
Classification Antirheumatic
Copyright Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 356.098391456 u
Formula C16H15F3N2O4
InChI InChI=1S/C16H15F3N2O4/c1-23-10-7-11(15(22)25-3)14(20-8-10)21-9-4-5-13(24-2)12(6-9)16(17,18)19/h4-8H,1-3H3,(H,20,21)
InChIKey DJCQEGXXKGPCEL-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 356.301 g/mol
SMILES c1(cnc(Nc2cc(C(F)(F)F)c(cc2)OC)c(C(OC)=O)c1)OC
SPLASH splash10-0a4i-0149000000-371b50972eab623e4201
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: UME
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_6382