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(5S,8R,9R)-1-Benzyl-10-methyl-8,9-dihydroxy-4,7-dioxo-5-methyl-3,6-diazadecanedicarboxylate
SpectraBase Compound ID JgtsfV9vfXu
InChI InChI=1S/C17H22N2O8/c1-10(19-16(24)13(21)14(22)17(25)26-2)15(23)18-8-12(20)27-9-11-6-4-3-5-7-11/h3-7,10,13-14,21-22H,8-9H2,1-2H3,(H,18,23)(H,19,24)/t10-,13+,14-/m0/s1
InChIKey WGWQYPIAJYUWFM-GDLCADMTSA-N
Mol Weight 382.37 g/mol
Molecular Formula C17H22N2O8
Exact Mass 382.137616 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B35Y1o1yYxE
Name (5S,8R,9R)-1-Benzyl-10-methyl-8,9-dihydroxy-4,7-dioxo-5-methyl-3,6-diazadecanedicarboxylate
Alternate Name(s) methyl (2S,3R)-4-[((1S)-2-{[2-(benzyloxy)-2-oxoethyl]amino}-1-methyl-2-oxoethyl)amino]-2,3-dihydroxy-4-oxobutanoate
Comments Less than 3 mono-isotopic peaks
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Formula C17H22N2O8
InChI InChI=1S/C17H22N2O8/c1-10(19-16(24)13(21)14(22)17(25)26-2)15(23)18-8-12(20)27-9-11-6-4-3-5-7-11/h3-7,10,13-14,21-22H,8-9H2,1-2H3,(H,18,23)(H,19,24)/t10-,13+,14-/m0/s1
InChIKey WGWQYPIAJYUWFM-GDLCADMTSA-N
Molecular Weight 382.369 g/mol
SMILES N(C([C@@]([C@@](C(=O)OC)(O)[H])(O)[H])=O)[C@](C(NCC(=O)OCc1ccccc1)=O)(C)[H]
SPLASH splash10-0006-0900000000-dd43b3bbd50d63b09583
Source of Spectrum QE-6-255-19
Wiley ID 844569