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[3-(benzenesulfonylmethyl)-4-nitrophenyl]-pentafluoro-$l^{6}-sulfane
SpectraBase Compound ID HYdZcfdpeuy
InChI InChI=1S/C13H10F5NO4S2/c14-25(15,16,17,18)12-6-7-13(19(20)21)10(8-12)9-24(22,23)11-4-2-1-3-5-11/h1-8H,9H2
InChIKey OAIYVOHECWCSJD-UHFFFAOYSA-N
Mol Weight 403.34 g/mol
Molecular Formula C13H10F5NO4S2
Exact Mass 402.997141 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID m1NCVIq7ZP
Name [3-(benzenesulfonylmethyl)-4-nitrophenyl]-pentafluoro-$l^{6}-sulfane
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H10F5NO4S2
InChI InChI=1S/C13H10F5NO4S2/c14-25(15,16,17,18)12-6-7-13(19(20)21)10(8-12)9-24(22,23)11-4-2-1-3-5-11/h1-8H,9H2
InChIKey OAIYVOHECWCSJD-UHFFFAOYSA-N
Literature Reference DOI 10.1021/jo200618p
Molecular Weight 403.338 g/mol
SMILES c1(S(F)(F)(F)(F)F)ccc([N+](=O)[O-])c(CS(c2ccccc2)(=O)=O)c1
SPLASH splash10-03fu-5390000000-0e5acdacb33492f9f393
Source of Spectrum J-76-4783-4a
Synonyms [3-(benzenesulfonylmethyl)-4-nitro-phenyl]-pentafluoro-$l^{6}-sulfane Pentakis(fluoranyl)-[4-nitro-3-(phenylsulfonylmethyl)phenyl]-$l^{6}-sulfane
Wiley ID 1744815