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3,4-DI-O-ACETYL-6-O-TRITYL-1,2-O-[1-(EXO-CYANO)ETHYLIDENE]-BETA-D-MANNOPYRANOSE
SpectraBase Compound ID CtSjVQr0MwH
InChI InChI=1S/C32H31NO8/c1-21(34)37-27-26(39-30-29(28(27)38-22(2)35)40-31(3,20-33)41-30)19-36-32(23-13-7-4-8-14-23,24-15-9-5-10-16-24)25-17-11-6-12-18-25/h4-18,26-30H,19H2,1-3H3/t26-,27-,28+,29+,30+,31+/m1/s1
InChIKey VWKWQJMCLAAZOA-CJKOIZGMSA-N
Mol Weight 557.6 g/mol
Molecular Formula C32H31NO8
Exact Mass 557.204967 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HEmoyMqw3r1
Name 3,4-DI-O-ACETYL-6-O-TRITYL-1,2-O-[1-(EXO-CYANO)ETHYLIDENE]-BETA-D-MANNOPYRANOSE
Comments
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Formula C32H31NO8
InChI InChI=1S/C32H31NO8/c1-21(34)37-27-26(39-30-29(28(27)38-22(2)35)40-31(3,20-33)41-30)19-36-32(23-13-7-4-8-14-23,24-15-9-5-10-16-24)25-17-11-6-12-18-25/h4-18,26-30H,19H2,1-3H3/t26-,27-,28+,29+,30+,31+/m1/s1
InChIKey VWKWQJMCLAAZOA-CJKOIZGMSA-N
Instrument Name Bruker WM-250
Literature Reference V.I.BETANELI, A.YA.OTT, O.V.BRYUKHANOV, N.K.KOCHETKOV (1986)Bioorganich.Khim.(Russ. Lang.): v.12, N12, 1685-1688.
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3