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1-(3-METHYLPHENYLETHYNYL)-3,4,6-TRI-O-BENZYL-GLUCAL
SpectraBase Compound ID JZhVRXmlfWc
InChI InChI=1S/C36H34O4/c1-28-12-11-19-29(22-28)20-21-33-23-34(38-25-31-15-7-3-8-16-31)36(39-26-32-17-9-4-10-18-32)35(40-33)27-37-24-30-13-5-2-6-14-30/h2-19,22-23,34-36H,24-27H2,1H3/t34-,35-,36+/m1/s1
InChIKey PZEKUSKHXBGENY-LBYVEUBFSA-N
Mol Weight 530.7 g/mol
Molecular Formula C36H34O4
Exact Mass 530.24571 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID A2PKDlDBYym
Name 1-(3-METHYLPHENYLETHYNYL)-3,4,6-TRI-O-BENZYL-GLUCAL
Compound Number 9EA
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C36H34O4
InChI InChI=1S/C36H34O4/c1-28-12-11-19-29(22-28)20-21-33-23-34(38-25-31-15-7-3-8-16-31)36(39-26-32-17-9-4-10-18-32)35(40-33)27-37-24-30-13-5-2-6-14-30/h2-19,22-23,34-36H,24-27H2,1H3/t34-,35-,36+/m1/s1
InChIKey PZEKUSKHXBGENY-LBYVEUBFSA-N
Literature Reference Author D.C.KOESTER,D.B.WERZ
Literature Reference Citation BEIL.J.ORG.CHEM.,8,675(2012)
Literature Reference DOI 10.3762/bjoc.8.75
Molecular Weight 530.664 g/mol
Solvent CDCl3
Source File Reference UWIR10511