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2,2-Dimethyl-1-(4'-nitrophenyl)propyl mesityl sulfide
SpectraBase Compound ID 7P3bgQPPFGN
InChI InChI=1S/C20H25NO2S/c1-13-11-14(2)18(15(3)12-13)24-19(20(4,5)6)16-7-9-17(10-8-16)21(22)23/h7-12,19H,1-6H3
InChIKey VVXGCPMBYNXOOP-UHFFFAOYSA-N
Mol Weight 343.49 g/mol
Molecular Formula C20H25NO2S
Exact Mass 343.1606 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 63sN0qYyUFb
Name 2,2-Dimethyl-1-(4'-nitrophenyl)propyl mesityl sulfide
Alternate Name(s) 2,2-Dimethyl-1-(4-nitrophenyl)propyl mesityl sulfide 2-{[2,2-dimethyl-1-(4-nitrophenyl)propyl]sulfanyl}-1,3,5-trimethylbenzene
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Formula C20H25NO2S
InChI InChI=1S/C20H25NO2S/c1-13-11-14(2)18(15(3)12-13)24-19(20(4,5)6)16-7-9-17(10-8-16)21(22)23/h7-12,19H,1-6H3
InChIKey VVXGCPMBYNXOOP-UHFFFAOYSA-N
Molecular Weight 343.485 g/mol
SMILES c1(SC(C(C)(C)C)c2ccc(cc2)N(=O)=O)c(C)cc(C)cc1C
SPLASH splash10-0udi-1931000000-68b6e7c51808bb678825
Source of Spectrum B-52-1082-5
Wiley ID 746870