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3-Chloro-4-methoxy-6-nitro-1,2-benzisothiazole
SpectraBase Compound ID B71D1rwEiCZ
InChI InChI=1S/C8H5ClN2O3S/c1-14-5-2-4(11(12)13)3-6-7(5)8(9)10-15-6/h2-3H,1H3
InChIKey ZROUUTOVDAQZQN-UHFFFAOYSA-N
Mol Weight 244.65 g/mol
Molecular Formula C8H5ClN2O3S
Exact Mass 243.970941 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GmfJ56epcN6
Name 3-Chloro-4-methoxy-6-nitro-1,2-benzisothiazole
Alternate Name(s) 3-Chloro-6-nitro-1,2-benzisothiazol-4-yl methyl ether
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H5ClN2O3S
InChI InChI=1S/C8H5ClN2O3S/c1-14-5-2-4(11(12)13)3-6-7(5)8(9)10-15-6/h2-3H,1H3
InChIKey ZROUUTOVDAQZQN-UHFFFAOYSA-N
Molecular Weight 244.652 g/mol
SMILES c1(nsc2cc(cc(c12)OC)N(=O)=O)Cl
SPLASH splash10-01oy-0690000000-688e0e93d6f706ad8d65
Source of Spectrum H1-68-2489-12
Wiley ID 1593723