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Dapsone 2TFA
SpectraBase Compound ID 7EbXQwVVzYn
InChI InChI=1S/C16H10F6N2O4S/c17-15(18,19)13(25)23-9-1-5-11(6-2-9)29(27,28)12-7-3-10(4-8-12)24-14(26)16(20,21)22/h1-8H,(H,23,25)(H,24,26)
InChIKey OKQAWNWYGNSBMM-UHFFFAOYSA-N
Mol Weight 440.32 g/mol
Molecular Formula C16H10F6N2O4S
Exact Mass 440.026547 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1nNAUIqhIu
Name Dapsone 2TFA
Classification Antibiotic
Copyright Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 440.026546958 u
Formula C16H10N2F6O4S
InChI InChI=1S/C16H10F6N2O4S/c17-15(18,19)13(25)23-9-1-5-11(6-2-9)29(27,28)12-7-3-10(4-8-12)24-14(26)16(20,21)22/h1-8H,(H,23,25)(H,24,26)
InChIKey OKQAWNWYGNSBMM-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 440.316 g/mol
SMILES c1cc(ccc1NC(C(F)(F)F)=O)S(=O)(c1ccc(cc1)NC(C(F)(F)F)=O)=O
SPLASH splash10-00ko-8950300000-110256b37c99498cfe53
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_6564