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2H-Benzoxathiol-2-one, 5-hydroxy-6-nitro-
SpectraBase Compound ID 1aPoQ9wNCGy
InChI InChI=1S/C7H3NO5S/c9-4-2-6-5(13-7(10)14-6)1-3(4)8(11)12/h1-2,9H
InChIKey ACTSWVCSDJJKMK-UHFFFAOYSA-N
Mol Weight 213.16 g/mol
Molecular Formula C7H3NO5S
Exact Mass 212.973193 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID K8Z65djeCHh
Name 2H-Benzoxathiol-2-one, 5-hydroxy-6-nitro-
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H3NO5S
InChI InChI=1S/C7H3NO5S/c9-4-2-6-5(13-7(10)14-6)1-3(4)8(11)12/h1-2,9H
InChIKey ACTSWVCSDJJKMK-UHFFFAOYSA-N
Molecular Weight 213.163 g/mol
SMILES Oc1c(N(=O)=O)cc2OC(=O)Sc2c1
SPLASH splash10-0udr-9000000000-681b80917932854b44b4
Synonyms 5-Hydroxy-6-nitro-1,3-benzoxathiol-2-one 6-Nitro-5-oxidanyl-1,3-benzoxathiol-2-one
Wiley ID 1454365