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2(3H)-benzoxazolone, 3-(methylsulfonyl)-6-nitro-
SpectraBase Compound ID EI2R6LHiB0l
InChI InChI=1S/C8H6N2O6S/c1-17(14,15)9-6-3-2-5(10(12)13)4-7(6)16-8(9)11/h2-4H,1H3
InChIKey SZXUSYMCZWRBCR-UHFFFAOYSA-N
Mol Weight 258.2 g/mol
Molecular Formula C8H6N2O6S
Exact Mass 257.994657 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EJjQErMNqy0
Name 3-(methylsulfonyl)-6-nitro-1,3-benzoxazol-2(3H)-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H6N2O6S
InChI InChI=1S/C8H6N2O6S/c1-17(14,15)9-6-3-2-5(10(12)13)4-7(6)16-8(9)11/h2-4H,1H3
InChIKey SZXUSYMCZWRBCR-UHFFFAOYSA-N
Molecular Weight 258.204 g/mol
SMILES CS(N1C(Oc2c1ccc(N(=O)=O)c2)=O)(=O)=O
SPLASH splash10-056r-6930000000-52de77182bfbe4ee3da7
Source of Spectrum IY-3-116-0
Synonyms 3-Methylsulfonyl-6-nitro-1,3-benzoxazol-2-one
Wiley ID 1718064