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4-(2,3,5-TRIBENZYLOXY-1,4-DIHYDROXY-D-ALTRO-PENT-1-YL)-3(5)-CARBOMETHOXYPYRAZOLE
SpectraBase Compound ID 8DH6z19tNpR
InChI InChI=1S/C31H34N2O7/c1-37-31(36)27-25(17-32-33-27)28(35)30(40-20-24-15-9-4-10-16-24)29(39-19-23-13-7-3-8-14-23)26(34)21-38-18-22-11-5-2-6-12-22/h2-17,26,28-30,34-35H,18-21H2,1H3,(H,32,33)/t26-,28-,29-,30+/m0/s1
InChIKey BEIDZEHUOONNDU-ZVVXMFRTSA-N
Mol Weight 546.6 g/mol
Molecular Formula C31H34N2O7
Exact Mass 546.236601 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7lbTwhrxR8H
Name 4-(2,3,5-TRIBENZYLOXY-1,4-DIHYDROXY-D-ALTRO-PENT-1-YL)-3(5)-CARBOMETHOXYPYRAZOLE
CAS Registry Number 59463-93-3
Compound Number 9A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C31H34N2O7
InChI InChI=1S/C31H34N2O7/c1-37-31(36)27-25(17-32-33-27)28(35)30(40-20-24-15-9-4-10-16-24)29(39-19-23-13-7-3-8-14-23)26(34)21-38-18-22-11-5-2-6-12-22/h2-17,26,28-30,34-35H,18-21H2,1H3,(H,32,33)/t26-,28-,29-,30+/m0/s1
InChIKey BEIDZEHUOONNDU-ZVVXMFRTSA-N
Literature Reference Author C.M.GUPTA,G.H.JONES,J.G.MOFFATT
Literature Reference Citation J.ORG.CHEM.,41,3000(1976)
Literature Reference DOI 10.1021/jo00880a017
Molecular Weight 546.620 g/mol
Solvent CDCl3
Source File Reference UWCS12550