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2H-Naphtho[1,8-cd]isothiazole, 2-[2-(2H-naphtho[1,8-cd]isothiazol-2-yl)ethyl]-, S,S,1,1-tetraoxide
SpectraBase Compound ID IakiNjJzpnD
InChI InChI=1S/C22H16N2O4S2/c25-29(26)19-11-3-7-15-5-1-9-17(21(15)19)23(29)13-14-24-18-10-2-6-16-8-4-12-20(22(16)18)30(24,27)28/h1-12H,13-14H2
InChIKey UQTHDQHZZUWXMX-UHFFFAOYSA-N
Mol Weight 436.5 g/mol
Molecular Formula C22H16N2O4S2
Exact Mass 436.055149 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2w1SLwI7Fzf
Name 2H-Naphtho[1,8-cd]isothiazole, 2-[2-(2H-naphtho[1,8-cd]isothiazol-2-yl)ethyl]-, S,S,1,1-tetraoxide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H16N2O4S2
InChI InChI=1S/C22H16N2O4S2/c25-29(26)19-11-3-7-15-5-1-9-17(21(15)19)23(29)13-14-24-18-10-2-6-16-8-4-12-20(22(16)18)30(24,27)28/h1-12H,13-14H2
InChIKey UQTHDQHZZUWXMX-UHFFFAOYSA-N
Molecular Weight 436.500 g/mol
SMILES C(CN1S(=O)(c2cccc3cccc1c23)=O)N1S(c2cccc3c2c1ccc3)(=O)=O
SPLASH splash10-00or-1940100000-fc729fcbe07c95e228cc
Source of Spectrum IY-1-4675-8
Wiley ID 1654741