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METHYL-2-BENZYLOXYCARBONYLAMINO-2,3-DIDEOXY-4,5:6,7-DI-O-ISOPROPYLIDENE-D-MANNO-HEPTONATE
SpectraBase Compound ID 6q5txhjyOwn
InChI InChI=1S/C22H31NO8/c1-21(2)28-13-17(30-21)18-16(29-22(3,4)31-18)11-15(19(24)26-5)23-20(25)27-12-14-9-7-6-8-10-14/h6-10,15-18H,11-13H2,1-5H3,(H,23,25)/t15-,16+,17+,18+/m0/s1
InChIKey KCWNDNBIGMVIED-BSDSXHPESA-N
Mol Weight 437.49 g/mol
Molecular Formula C22H31NO8
Exact Mass 437.204967 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID ANPTFbWlLKg
Name METHYL-2-BENZYLOXYCARBONYLAMINO-2,3-DIDEOXY-4,5:6,7-DI-O-ISOPROPYLIDENE-D-MANNO-HEPTONATE
Compound Number 9
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H31NO8
InChI InChI=1S/C22H31NO8/c1-21(2)28-13-17(30-21)18-16(29-22(3,4)31-18)11-15(19(24)26-5)23-20(25)27-12-14-9-7-6-8-10-14/h6-10,15-18H,11-13H2,1-5H3,(H,23,25)/t15-,16+,17+,18+/m0/s1
InChIKey KCWNDNBIGMVIED-BSDSXHPESA-N
Literature Reference Author M.J.SIMIRGIOTIS,J.VALLEJOS,C.ARECHE,B.SEPULVEDA
Literature Reference Citation MOLECULES,19,19516(2014)
Literature Reference DOI 10.3390/molecules191219516
Molecular Weight 437.490 g/mol
Solvent CDCl3
Source File Reference UWLU81591