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Carbamic acid, N-[2,2-bis(phenylsulfonyl)ethyl]-, t-butyl ester
SpectraBase Compound ID 4Sv3Zzw96xa
InChI InChI=1S/C19H21NO6S2/c1-19(2,3)26-18(21)20-14-17(27(22,23)15-10-6-4-7-11-15)28(24,25)16-12-8-5-9-13-16/h4-14H,1-3H3,(H,20,21)
InChIKey UAPOSQLITASXAR-UHFFFAOYSA-N
Mol Weight 423.5 g/mol
Molecular Formula C19H21NO6S2
Exact Mass 423.08103 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Dv44FViyctf
Name Carbamic acid, N-[2,2-bis(phenylsulfonyl)ethyl]-, T-butyl ester
Comments Computed using HOSE algorithm
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Exact Mass 423.081029742 u
Formula C19H21NO6S2
InChI InChI=1S/C19H21NO6S2/c1-19(2,3)26-18(21)20-14-17(27(22,23)15-10-6-4-7-11-15)28(24,25)16-12-8-5-9-13-16/h4-14H,1-3H3,(H,20,21)
InChIKey UAPOSQLITASXAR-UHFFFAOYSA-N
Molecular Weight 423.498 g/mol
SMILES C1=CC(S(=O)(=O)C(=CNC(OC(C)(C)C)=O)S(C2=CC=CC=C2)(=O)=O)=CC=C1