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(5S,8R,9R)-1-Benzyl-10-methy 8,9-bis(benzoyloxy)-4,7-dioxo-5-methyl-3,6-diazadecanedicarboxylate
SpectraBase Compound ID BrVjehQ9SGq
InChI InChI=1S/C31H30N2O10/c1-20(27(35)32-18-24(34)41-19-21-12-6-3-7-13-21)33-28(36)25(42-29(37)22-14-8-4-9-15-22)26(31(39)40-2)43-30(38)23-16-10-5-11-17-23/h3-17,20,25-26H,18-19H2,1-2H3,(H,32,35)(H,33,36)/t20-,25+,26+/m0/s1
InChIKey FYRZFJDBTAMGIE-GKBBYZSKSA-N
Mol Weight 590.59 g/mol
Molecular Formula C31H30N2O10
Exact Mass 590.190045 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4EAtipTKiz5
Name (5S,8R,9R)-1-Benzyl-10-methy 8,9-bis(benzoyloxy)-4,7-dioxo-5-methyl-3,6-diazadecanedicarboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C31H30N2O10
InChI InChI=1S/C31H30N2O10/c1-20(27(35)32-18-24(34)41-19-21-12-6-3-7-13-21)33-28(36)25(42-29(37)22-14-8-4-9-15-22)26(31(39)40-2)43-30(38)23-16-10-5-11-17-23/h3-17,20,25-26H,18-19H2,1-2H3,(H,32,35)(H,33,36)/t20-,25+,26+/m0/s1
InChIKey FYRZFJDBTAMGIE-GKBBYZSKSA-N
Molecular Weight 590.585 g/mol
SMILES N(C([C@@]([C@@](OC(=O)c1ccccc1)(C(=O)OC)[H])(OC(=O)c1ccccc1)[H])=O)[C@](C(NCC(=O)OCc1ccccc1)=O)(C)[H]
SPLASH splash10-056u-0000690000-27f7da57e0df7a8b60ee
Source of Spectrum QE-6-253-12
Wiley ID 844573