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DIHYDROBICYCLOMYCIN-5A-PROPIONIC-ACID-C-(2'),C-(3')-ACETONIDE
SpectraBase Compound ID 5KzbPna7yme
InChI InChI=1S/C18H28N2O9/c1-15(2)28-9-16(3,29-15)12(23)18-14(25)19-17(26,13(24)20-18)10(7-8-27-18)5-4-6-11(21)22/h10,12,23,26H,4-9H2,1-3H3,(H,19,25)(H,20,24)(H,21,22)/t10-,12?,16?,17+,18-/m1/s1
InChIKey XMGVTFARCHDEEV-YXJVNDFSSA-N
Mol Weight 416.43 g/mol
Molecular Formula C18H28N2O9
Exact Mass 416.17948 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2qIieLcaPxp
Name DIHYDROBICYCLOMYCIN-5A-PROPIONIC-ACID-C-(2'),C-(3')-ACETONIDE
Compound Number 45
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H28N2O9
InChI InChI=1S/C18H28N2O9/c1-15(2)28-9-16(3,29-15)12(23)18-14(25)19-17(26,13(24)20-18)10(7-8-27-18)5-4-6-11(21)22/h10,12,23,26H,4-9H2,1-3H3,(H,19,25)(H,20,24)(H,21,22)/t10-,12?,16?,17+,18-/m1/s1
InChIKey XMGVTFARCHDEEV-YXJVNDFSSA-N
Literature Reference Author F.VINCENT,J.SRINIVASAN,A.SANTILLAN,W.R.WIDGER,H.KOHN
Literature Reference Citation J.ORG.CHEM.,66,2251(2001)
Literature Reference DOI 10.1021/jo0013150
Molecular Weight 416.428 g/mol
Solvent CD3OD
Source File Reference UWLU26262