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cis and trans-2-n-Butyl-4-ethyl-3,4-diphenyl-1,2-thiazetidine 1,1-dioxide
SpectraBase Compound ID HeUxZF8h6XP
InChI InChI=1S/C20H25NO2S/c1-3-5-16-21-19(17-12-8-6-9-13-17)20(4-2,24(21,22)23)18-14-10-7-11-15-18/h6-15,19H,3-5,16H2,1-2H3/t19-,20+/m0/s1
InChIKey GLLPUMIFGLEUIK-VQTJNVASSA-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 3OiD9IYBIyd
Name cis and trans-2-n-Butyl-4-ethyl-3,4-diphenyl-1,2-thiazetidine 1,1-dioxide
Alternate Name(s) (3S,4R)-2-butyl-4-ethyl-3,4-diphenyl-1,2-thiazetidine 1,1-dioxide
Comments Less than 3 mono-isotopic peaks
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Formula C20H25NO2S
InChI InChI=1S/C20H25NO2S/c1-3-5-16-21-19(17-12-8-6-9-13-17)20(4-2,24(21,22)23)18-14-10-7-11-15-18/h6-15,19H,3-5,16H2,1-2H3/t19-,20+/m0/s1
InChIKey GLLPUMIFGLEUIK-VQTJNVASSA-N
Molecular Weight 343.485 g/mol
SMILES [C@]1(S(N([C@]1(c1ccccc1)[H])CCCC)(=O)=O)(c1ccccc1)CC
SPLASH splash10-004l-0098000000-3bc8c5a9cde29beba5a4
Source of Spectrum F-54-8962-6
Wiley ID 807911