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3,4-DI-O-BENZOYL-1,2-O-(1-EXO-CYANOETHYLIDENE)-ALPHA-D-XYLOPYRANOSE
SpectraBase Compound ID 8NLzvSjIWqM
InChI InChI=1S/C22H19NO7/c1-22(13-23)29-18-17(28-20(25)15-10-6-3-7-11-15)16(12-26-21(18)30-22)27-19(24)14-8-4-2-5-9-14/h2-11,16-18,21H,12H2,1H3/t16-,17+,18-,21-,22-/m1/s1
InChIKey WNMJJIMAEKDVPJ-PEWUMXJESA-N
Mol Weight 409.39 g/mol
Molecular Formula C22H19NO7
Exact Mass 409.116152 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6Qh5ZQZbw9l
Name 3,4-DI-O-BENZOYL-1,2-O-[(1-EXO-CYANO)ETHYLIDENE]-ALPHA-D-XYLOPYRANOSE
Comments =
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C22H19NO7
InChI InChI=1S/C22H19NO7/c1-22(13-23)29-18-17(28-20(25)15-10-6-3-7-11-15)16(12-26-21(18)30-22)27-19(24)14-8-4-2-5-9-14/h2-11,16-18,21H,12H2,1H3/t16-,17+,18-,21-,22-/m1/s1
InChIKey WNMJJIMAEKDVPJ-PEWUMXJESA-N
Instrument Name Bruker WP-60
Literature Reference L.V.BAKINOVSKY, N.E.NIFANT'EV, V.I.BETANELI, M.I.STRUCHKOVA, N.K.KOCHETKOV(1983) Bioorganich.Khim.(Russ. Lang.): v.9, N1, 74-86.
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3