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1-(4-Nitrophenyl)-3-phenyl-4,5-dihydro-3H-isothiazole 1-oxide
SpectraBase Compound ID 8QjKq5I7tOu
InChI InChI=1S/C15H14N2O3S/c18-17(19)13-6-8-14(9-7-13)21(20)11-10-15(16-21)12-4-2-1-3-5-12/h1-9,15H,10-11H2
InChIKey BRCMAVQKKNSRPB-UHFFFAOYSA-N
Mol Weight 302.35 g/mol
Molecular Formula C15H14N2O3S
Exact Mass 302.072513 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID C9Q8Es7WfWU
Name 1-(4-Nitrophenyl)-3-phenyl-4,5-dihydro-3H-isothiazole 1-oxide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H14N2O3S
InChI InChI=1S/C15H14N2O3S/c18-17(19)13-6-8-14(9-7-13)21(20)11-10-15(16-21)12-4-2-1-3-5-12/h1-9,15H,10-11H2
InChIKey BRCMAVQKKNSRPB-UHFFFAOYSA-N
Literature Reference DOI 10.1002/adsc.201701178
Molecular Weight 302.348 g/mol
SMILES c1([N+]([O-])=O)ccc(cc1)S1(=O)=NC(c2ccccc2)CC1
SPLASH splash10-004i-9850000000-b2160d9526ca21fc4c9b
Source of Spectrum ASC-359-SM11-2g
Wiley ID 1811654