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N-Mesyl-1,4,5-trimethoxy-2-(3,4,5-trimethoxy-2-methoxycarbonylanilino)benzene
SpectraBase Compound ID LOQ912UmG4y
InChI InChI=1S/C21H27NO10S/c1-26-14-11-16(28-3)15(27-2)9-12(14)22(33(8,24)25)13-10-17(29-4)19(30-5)20(31-6)18(13)21(23)32-7/h9-11H,1-8H3
InChIKey GSICVHXCEZMNCF-UHFFFAOYSA-N
Mol Weight 485.5 g/mol
Molecular Formula C21H27NO10S
Exact Mass 485.135567 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DmiOPNpbAkP
Name N-Mesyl-1,4,5-trimethoxy-2-(3,4,5-trimethoxy-2-methoxycarbonylanilino)benzene
Alternate Name(s) methyl 2,3,4-trimethoxy-6-[2,4,5-trimethoxy(methylsulfonyl)anilino]benzoate
Comments Less than 3 mono-isotopic peaks
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Formula C21H27NO10S
InChI InChI=1S/C21H27NO10S/c1-26-14-11-16(28-3)15(27-2)9-12(14)22(33(8,24)25)13-10-17(29-4)19(30-5)20(31-6)18(13)21(23)32-7/h9-11H,1-8H3
InChIKey GSICVHXCEZMNCF-UHFFFAOYSA-N
Molecular Weight 485.504 g/mol
SMILES CS(N(c1cc(OC)c(cc1OC)OC)c1c(c(OC)c(c(c1)OC)OC)C(=O)OC)(=O)=O
SPLASH splash10-00di-0009200000-abe915f42d1902961aa0
Source of Spectrum H1-36-2120-6
Wiley ID 755498