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3-Chloro-3-[(1'-benzyl-4',5'-diphenyl-1H-imidazol-2'-yl)disulfanyl]-2,2,4,4-tetramethylcyclobutanone
SpectraBase Compound ID 8dcJZy1gckE
InChI InChI=1S/C30H29ClN2OS2/c1-28(2)26(34)29(3,4)30(28,31)36-35-27-32-24(22-16-10-6-11-17-22)25(23-18-12-7-13-19-23)33(27)20-21-14-8-5-9-15-21/h5-19H,20H2,1-4H3
InChIKey HQPFBDXWPVHDLJ-UHFFFAOYSA-N
Mol Weight 533.15 g/mol
Molecular Formula C30H29ClN2OS2
Exact Mass 532.140984 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KWrODhr9N3G
Name 3-Chloro-3-[(1'-benzyl-4',5'-diphenyl-1H-imidazol-2'-yl)disulfanyl]-2,2,4,4-tetramethylcyclobutanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C30H29ClN2OS2
InChI InChI=1S/C30H29ClN2OS2/c1-28(2)26(34)29(3,4)30(28,31)36-35-27-32-24(22-16-10-6-11-17-22)25(23-18-12-7-13-19-23)33(27)20-21-14-8-5-9-15-21/h5-19H,20H2,1-4H3
InChIKey HQPFBDXWPVHDLJ-UHFFFAOYSA-N
Molecular Weight 533.148 g/mol
SMILES C1(C(C)(C)C(C1(C)C)=O)(SSc1[n](c(-c2ccccc2)c(n1)-c1ccccc1)Cc1ccccc1)Cl
SPLASH splash10-0006-9420050000-37d86bfbbb579808b4d0
Source of Spectrum H-86-2280-9
Synonyms 3-[(1-benzyl-4,5-diphenyl-1H-imidazol-2-yl)disulfanyl]-3-chloro-2,2,4,4-tetramethylcyclobutanone
Wiley ID 1525500