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2,2-Dimethyl-1-(4'-nitrophenyl)propyl 2",4",6"-tri(t-butyl)phenyl sulfide
SpectraBase Compound ID HGEWvl0cO7K
InChI InChI=1S/C29H43NO2S/c1-26(2,3)20-17-22(27(4,5)6)24(23(18-20)28(7,8)9)33-25(29(10,11)12)19-13-15-21(16-14-19)30(31)32/h13-18,25H,1-12H3
InChIKey JZEVYHHSXANMMG-UHFFFAOYSA-N
Mol Weight 469.7 g/mol
Molecular Formula C29H43NO2S
Exact Mass 469.301451 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID J1GGJP3RXhQ
Name 2,2-Dimethyl-1-(4'-nitrophenyl)propyl 2",4",6"-tri(t-butyl)phenyl sulfide
Alternate Name(s) 1,3,5-tritert-butyl-2-{[2,2-dimethyl-1-(4-nitrophenyl)propyl]sulfanyl}benzene 2,2-Dimethyl-1-(4-nitrophenyl)propyl 2,4,6-tritert-butylphenyl sulfide
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Formula C29H43NO2S
InChI InChI=1S/C29H43NO2S/c1-26(2,3)20-17-22(27(4,5)6)24(23(18-20)28(7,8)9)33-25(29(10,11)12)19-13-15-21(16-14-19)30(31)32/h13-18,25H,1-12H3
InChIKey JZEVYHHSXANMMG-UHFFFAOYSA-N
Molecular Weight 469.728 g/mol
SMILES c1(c(cc(cc1C(C)(C)C)C(C)(C)C)C(C)(C)C)SC(C(C)(C)C)c1ccc(N(=O)=O)cc1
SPLASH splash10-0a4i-9130100000-d245fc25630fe057318b
Source of Spectrum B-52-1082-8
Wiley ID 746869