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9,9-Dimethyl-N-chloro-4-nitro-7-thia-8-axa-bicyclo[4.3.]]nona-1,3,5-triene-7,7-dioxide
SpectraBase Compound ID 2ZAgUgqowmj
InChI InChI=1S/C9H9ClN2O4S/c1-9(2)7-4-3-6(11(13)14)5-8(7)17(15,16)12(9)10/h3-5H,1-2H3
InChIKey WNMWNOJMKAOKMN-UHFFFAOYSA-N
Mol Weight 276.69 g/mol
Molecular Formula C9H9ClN2O4S
Exact Mass 275.997156 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3fjafsjZL6
Name 9,9-Dimethyl-N-chloro-4-nitro-7-thia-8-axa-bicyclo[4.3.]]nona-1,3,5-triene-7,7-dioxide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H9ClN2O4S
InChI InChI=1S/C9H9ClN2O4S/c1-9(2)7-4-3-6(11(13)14)5-8(7)17(15,16)12(9)10/h3-5H,1-2H3
InChIKey WNMWNOJMKAOKMN-UHFFFAOYSA-N
Molecular Weight 276.694 g/mol
SMILES C1(N(S(c2c1ccc(c2)N(=O)=O)(=O)=O)Cl)(C)C
SPLASH splash10-03fr-0190000000-4411cd04b3df8ac325e4
Source of Spectrum C-115-6599-2
Synonyms 2-Chloro-3,3-dimethyl-6-nitro-2,3-dihydro-1,2-benzisothiazole 1,1-dioxide
Wiley ID 1279450