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2",4",6"-Triisopropylphenyl 1,2,2-trimethyl-1-(4'-nitrophenyl)propyl sulfide
SpectraBase Compound ID 7lTndOr8MLR
InChI InChI=1S/C27H39NO2S/c1-17(2)20-15-23(18(3)4)25(24(16-20)19(5)6)31-27(10,26(7,8)9)21-11-13-22(14-12-21)28(29)30/h11-19H,1-10H3
InChIKey MMJFWWKDDBXXMR-UHFFFAOYSA-N
Mol Weight 441.7 g/mol
Molecular Formula C27H39NO2S
Exact Mass 441.270151 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6Cuk4uJZG16
Name 2",4",6"-Triisopropylphenyl 1,2,2-trimethyl-1-(4'-nitrophenyl)propyl sulfide
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Formula C27H39NO2S
InChI InChI=1S/C27H39NO2S/c1-17(2)20-15-23(18(3)4)25(24(16-20)19(5)6)31-27(10,26(7,8)9)21-11-13-22(14-12-21)28(29)30/h11-19H,1-10H3
InChIKey MMJFWWKDDBXXMR-UHFFFAOYSA-N
Molecular Weight 441.674 g/mol
SMILES c1(SC(C(C)(C)C)(c2ccc(N(=O)=O)cc2)C)c(cc(cc1C(C)C)C(C)C)C(C)C
SPLASH splash10-000i-0290000000-69a586be967504e8443b
Source of Spectrum B-52-1082-10
Synonyms 1,3,5-triisopropyl-2-{[1,2,2-trimethyl-1-(4-nitrophenyl)propyl]sulfanyl}benzene 2,4,6-triisopropylphenyl 1,2,2-trimethyl-1-(4-nitrophenyl)propyl sulfide
Wiley ID 746867