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3,3-bis(oxidanyl)-1,5-dihydro-1,5-benzodiazepine-2,4-dione
SpectraBase Compound ID mWt2JOWMuh
InChI InChI=1S/C9H8N2O4/c12-7-9(14,15)8(13)11-6-4-2-1-3-5(6)10-7/h1-4,14-15H,(H,10,12)(H,11,13)
InChIKey TWNFBSXWKYLBQG-UHFFFAOYSA-N
Mol Weight 208.17 g/mol
Molecular Formula C9H8N2O4
Exact Mass 208.048407 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5d8fFNH6Deh
Name 3,3-bis(oxidanyl)-1,5-dihydro-1,5-benzodiazepine-2,4-dione
CAS Registry Number 81225-99-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H8N2O4
InChI InChI=1S/C9H8N2O4/c12-7-9(14,15)8(13)11-6-4-2-1-3-5(6)10-7/h1-4,14-15H,(H,10,12)(H,11,13)
InChIKey TWNFBSXWKYLBQG-UHFFFAOYSA-N
Molecular Weight 208.173 g/mol
SMILES N1c2c(cccc2)NC(C(C1=O)(O)O)=O
SPLASH splash10-000x-0900000000-19360d3c91144afadc2a
Source of Spectrum K-115-599-0
Synonyms 3,3-Dihydroxy-1,5-dihydro-1,5-benzodiazepine-2,4-dione 3,3-Dihydroxy-1,5-dihydro-1,5-benzodiazepine-2,4-quinone 3,3-Dihydroxy-1H-1,5-benzodiazepine-2,4(3H,5H)-dione NSC 377139
Wiley ID 1206282