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Sulfanitran
SpectraBase Compound ID DCKzhaAB893
InChI InChI=1S/C14H13N3O5S/c1-10(18)15-11-4-8-14(9-5-11)23(21,22)16-12-2-6-13(7-3-12)17(19)20/h2-9,16H,1H3,(H,15,18)
InChIKey GWBPFRGXNGPPMF-UHFFFAOYSA-N
Mol Weight 335.33 g/mol
Molecular Formula C14H13N3O5S
Exact Mass 335.057592 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8KFHxeifTWK
Name Sulfanitran
CAS Registry Number 122-16-7
Classification Pharmaceutical drug, bacteriostatic
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 335.057591700 u
Formula C14H13N3O5S
InChI InChI=1S/C14H13N3O5S/c1-10(18)15-11-4-8-14(9-5-11)23(21,22)16-12-2-6-13(7-3-12)17(19)20/h2-9,16H,1H3,(H,15,18)
InChIKey GWBPFRGXNGPPMF-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 335.334 g/mol
Nominal Mass 335 u
Quality 921
Retention Index 2671
SMILES C=1(S(NC=2C=CC(=CC2)[N+](=O)[O-])(=O)=O)C=CC(NC(=O)C)=CC1
SPLASH splash10-0002-0902000000-667079fe67bdbb606efa
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms N-[4-[(4-Nitrophenyl)sulfamoyl]phenyl]acetamide
Technique GC/MS
Wiley ID DD2024_003953