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t-Butyl 2,2-dimethyl-3-{4'-[(naphthalen-2"-yl)methyl]-1',1',3'-trioxo-1-.lambda( 6).,2,5-thiadiazolan-2'-yl}-propanoate
SpectraBase Compound ID KZDzGR1uATQ
InChI InChI=1S/C22H28N2O5S/c1-21(2,3)29-20(26)22(4,5)14-24-19(25)18(23-30(24,27)28)13-15-10-11-16-8-6-7-9-17(16)12-15/h6-12,18,23H,13-14H2,1-5H3
InChIKey AVUMOQBRYQYXSU-UHFFFAOYSA-N
Mol Weight 432.54 g/mol
Molecular Formula C22H28N2O5S
Exact Mass 432.171893 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GpaTrp7gFhb
Name t-Butyl 2,2-dimethyl-3-{4'-[(naphthalen-2"-yl)methyl]-1',1',3'-trioxo-1-.lambda( 6).,2,5-thiadiazolan-2'-yl}-propanoate
Alternate Name(s) t-Butyl 2,2-dimethyl-3-{4'-[(naphthalen-2''-yl)methyl]-1',1',3'-trioxo-1-.lambda(6).,2,5-thiadiazolan-2'-yl}-propanoate tert-Butyl 2,2-dimethyl-3-[4-(2-naphthylmethyl)-1,1-dioxido-3-oxo-1,2,5-thiadiazolidin-2-yl]propanoate
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Formula C22H28N2O5S
InChI InChI=1S/C22H28N2O5S/c1-21(2,3)29-20(26)22(4,5)14-24-19(25)18(23-30(24,27)28)13-15-10-11-16-8-6-7-9-17(16)12-15/h6-12,18,23H,13-14H2,1-5H3
InChIKey AVUMOQBRYQYXSU-UHFFFAOYSA-N
Molecular Weight 432.535 g/mol
SMILES N1C(C(N(S1(=O)=O)CC(C(OC(C)(C)C)=O)(C)C)=O)Cc1cc2ccccc2cc1
SPLASH splash10-0006-0913300000-6f1463c7afd29c007db6
Source of Spectrum H-82-2445-21
Wiley ID 815727