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4-(4-Benzoylphenyl)-3-methanethiosulfonylmethyl-2,2,5,5-tetramethyl-2,5-dihydro-1H-pyrrol-1-yloxyl radical
SpectraBase Compound ID 24SBvHFOLn5
InChI InChI=1S/C23H26NO4S2/c1-22(2)19(15-30(27,28)29-5)20(23(3,4)24(22)26)16-11-13-18(14-12-16)21(25)17-9-7-6-8-10-17/h6-14H,15H2,1-5H3
InChIKey LCKJTWJMDFMMCL-UHFFFAOYSA-N
Mol Weight 445.59 g/mol
Molecular Formula C23H27NO4S2
Exact Mass 445.138151 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9SRLATuXann
Name 4-(4-Benzoylphenyl)-3-methanethiosulfonylmethyl-2,2,5,5-tetramethyl-2,5-dihydro-1H-pyrrol-1-yloxyl radical
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H26NO4S2
InChI InChI=1S/C23H26NO4S2/c1-22(2)19(15-30(27,28)29-5)20(23(3,4)24(22)26)16-11-13-18(14-12-16)21(25)17-9-7-6-8-10-17/h6-14H,15H2,1-5H3
InChIKey LCKJTWJMDFMMCL-UHFFFAOYSA-N
Molecular Weight 445.592 g/mol
SMILES ON1C(C(=C(C1(C)C)c1ccc(C(=O)c2ccccc2)cc1)CS(=O)(=O)SC)(C)C
SPLASH splash10-0a6r-5900300000-c0877200b53926c57353
Source of Spectrum F4-0-443-5
Wiley ID 1619263