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1H-1-Methyl-3-(1-phenylethylene)-4-nitro-2,2-dioxobenzoc]isothiazole
SpectraBase Compound ID ECWx2vUFxpp
InChI InChI=1S/C16H14N2O4S/c1-11(12-7-4-3-5-8-12)16-15-13(17(2)23(16,21)22)9-6-10-14(15)18(19)20/h3-10H,1-2H3/b16-11-
InChIKey LQNBVEODPIGTSN-WJDWOHSUSA-N
Mol Weight 330.36 g/mol
Molecular Formula C16H14N2O4S
Exact Mass 330.067428 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LJQU9ffinUq
Name 1H-1-Methyl-3-(1-phenylethylene)-4-nitro-2,2-dioxobenzoc]isothiazole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H14N2O4S
InChI InChI=1S/C16H14N2O4S/c1-11(12-7-4-3-5-8-12)16-15-13(17(2)23(16,21)22)9-6-10-14(15)18(19)20/h3-10H,1-2H3/b16-11-
InChIKey LQNBVEODPIGTSN-WJDWOHSUSA-N
Molecular Weight 330.358 g/mol
SMILES c12\C(S(N(c1cccc2N(=O)=O)C)(=O)=O)=C\(c1ccccc1)C
SPLASH splash10-0udi-0098000000-81cdd39acf773d2c3224
Source of Spectrum KC-57-7907-10
Wiley ID 1625774