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N-[(E)-[(4S,5R)-5-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-2,2-dimethyl-1,3-dioxolan-4-yl]methyleneamino]-4-methyl-benzenesulfonamide
SpectraBase Compound ID DKSNK525SCx
InChI InChI=1S/C18H26N2O6S/c1-12-6-8-13(9-7-12)27(21,22)20-19-10-14-16(26-18(4,5)24-14)15-11-23-17(2,3)25-15/h6-10,14-16,20H,11H2,1-5H3/b19-10+/t14-,15+,16+/m0/s1
InChIKey XSYPMPGPERYIKJ-HQBSMCSISA-N
Mol Weight 398.47 g/mol
Molecular Formula C18H26N2O6S
Exact Mass 398.151158 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FVKhFDY75cK
Name N-[(E)-[(4S,5R)-5-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-2,2-dimethyl-1,3-dioxolan-4-yl]methyleneamino]-4-methyl-benzenesulfonamide
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Formula C18H26N2O6S
InChI InChI=1S/C18H26N2O6S/c1-12-6-8-13(9-7-12)27(21,22)20-19-10-14-16(26-18(4,5)24-14)15-11-23-17(2,3)25-15/h6-10,14-16,20H,11H2,1-5H3/b19-10+/t14-,15+,16+/m0/s1
InChIKey XSYPMPGPERYIKJ-HQBSMCSISA-N
Molecular Weight 398.474 g/mol
SMILES N(S(c1ccc(cc1)C)(=O)=O)\N=C\[C@]1([C@]([C@@]2(OC(C)(C)OC2)[H])(OC(O1)(C)C)[H])[H]
SPLASH splash10-0pc3-9826000000-9cc81c7b3b63210960ce
Source of Spectrum SO-0-34-5
Synonyms N-[(E)-[(4S,5R)-5-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-2,2-dimethyl-1,3-dioxolan-4-yl]methylideneamino]-4-methyl-benzenesulfonamide
Wiley ID 875243