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1,3-BIS-(2',3',4',6'-TETRA-O-BENZOYL-ALPHA-D-MANNOPYRANOSYLOXY)-2-(AZIDOMETHYL)-PROPANE
SpectraBase Compound ID EhhkYQ76tuE
InChI InChI=1S/C72H61N3O20/c73-75-74-41-46(42-86-71-61(94-69(82)53-37-21-7-22-38-53)59(92-67(80)51-33-17-5-18-34-51)57(90-65(78)49-29-13-3-14-30-49)55(88-71)44-84-63(76)47-25-9-1-10-26-47)43-87-72-62(95-70(83)54-39-23-8-24-40-54)60(93-68(81)52-35-19-6-20-36-52)58(91-66(79)50-31-15-4-16-32-50)56(89-72)45-85-64(77)48-27-11-2-12-28-48/h1-40,46,55-62,71-72H,41-45H2/t46?,55-,56+,57-,58+,59+,60-,61+,62-,71+,72-
InChIKey SZEXWHKKTCFBLT-DHSJOCRCSA-N
Mol Weight 1288.3 g/mol
Molecular Formula C72H61N3O20
Exact Mass 1287.384841 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4o2iTHeX5dX
Name 1,3-BIS-(2',3',4',6'-TETRA-O-BENZOYL-ALPHA-D-MANNOPYRANOSYLOXY)-2-(AZIDOMETHYL)-PROPANE
Compound Number 10
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C72H61N3O20
InChI InChI=1S/C72H61N3O20/c73-75-74-41-46(42-86-71-61(94-69(82)53-37-21-7-22-38-53)59(92-67(80)51-33-17-5-18-34-51)57(90-65(78)49-29-13-3-14-30-49)55(88-71)44-84-63(76)47-25-9-1-10-26-47)43-87-72-62(95-70(83)54-39-23-8-24-40-54)60(93-68(81)52-35-19-6-20-36-52)58(91-66(79)50-31-15-4-16-32-50)56(89-72)45-85-64(77)48-27-11-2-12-28-48/h1-40,46,55-62,71-72H,41-45H2/t46?,55-,56+,57-,58+,59+,60-,61+,62-,71+,72-
InChIKey SZEXWHKKTCFBLT-DHSJOCRCSA-N
Literature Reference Author M.WALTER,M.WIEGAND,T.K.LINDHORST
Literature Reference Citation EUR.J.ORG.CHEM.,719(2006)
Molecular Weight 1288.284 g/mol
Sample ID 43190
Solvent CDCl3