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Methyl (1S,2R,4'S)-(-)-1-[N-(benzyloxycarbonyl)amino]-2-(2',2'-dimethyl-1',3'-dioxolan-4'-yl)cyclopropyl-1-carbonyl-N-[(R)-2-phenylglycinate]
SpectraBase Compound ID DMbOY5raPFH
InChI InChI=1S/C26H30N2O7/c1-25(2)34-16-20(35-25)19-14-26(19,28-24(31)33-15-17-10-6-4-7-11-17)23(30)27-21(22(29)32-3)18-12-8-5-9-13-18/h4-13,19-21H,14-16H2,1-3H3,(H,27,30)(H,28,31)/t19-,20+,21+,26-/m0/s1
InChIKey XLUXVLUAIIMOEZ-BPUGDSSMSA-N
Mol Weight 482.53 g/mol
Molecular Formula C26H30N2O7
Exact Mass 482.205301 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DdH5c8He70k
Name Methyl (1S,2R,4'S)-(-)-1-[N-(benzyloxycarbonyl)amino]-2-(2',2'-dimethyl-1',3'-dioxolan-4'-yl)cyclopropyl-1-carbonyl-N-[(R)-2-phenylglycinate]
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Formula C26H30N2O7
InChI InChI=1S/C26H30N2O7/c1-25(2)34-16-20(35-25)19-14-26(19,28-24(31)33-15-17-10-6-4-7-11-17)23(30)27-21(22(29)32-3)18-12-8-5-9-13-18/h4-13,19-21H,14-16H2,1-3H3,(H,27,30)(H,28,31)/t19-,20+,21+,26-/m0/s1
InChIKey XLUXVLUAIIMOEZ-BPUGDSSMSA-N
Molecular Weight 482.533 g/mol
SMILES N(C([C@]1([C@]([C@@]2(OC(C)(C)OC2)[H])(C1)[H])NC(=O)OCc1ccccc1)=O)[C@@](C(=O)OC)(c1ccccc1)[H]
SPLASH splash10-0006-9400000000-cec010b8602204d05808
Source of Spectrum QC-8-2470-9
Wiley ID 870176