John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=KvIwXhdOwkj SpectraBase Spectrum ID=1L1GedVDvR2

(accessed ).
4-NITROPHENYL_4-O-BENZOYL-2,3-O-ISOPROPYLIDENE-5-THIO-ALPHA-L-ARABINOPYRANOSIDE;MAJOR_ISOMER
SpectraBase Compound ID KvIwXhdOwkj
InChI InChI=1S/C21H21NO7S/c1-21(2)28-17-16(27-19(23)13-6-4-3-5-7-13)12-30-20(18(17)29-21)26-15-10-8-14(9-11-15)22(24)25/h3-11,16-18,20H,12H2,1-2H3/t16-,17-,18+,20-/m0/s1
InChIKey UWKHUCOPECBJGN-GNBUJSLZSA-N
Mol Weight 431.46 g/mol
Molecular Formula C21H21NO7S
Exact Mass 431.103874 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1L1GedVDvR2
Name 4-NITROPHENYL_4-O-BENZOYL-2,3-O-ISOPROPYLIDENE-5-THIO-ALPHA-L-ARABINOPYRANOSIDE;MAJOR_ISOMER
Compound Number 22-ALPHA
Copyright Copyright © 2016-2021 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H21NO7S
InChI InChI=1S/C21H21NO7S/c1-21(2)28-17-16(27-19(23)13-6-4-3-5-7-13)12-30-20(18(17)29-21)26-15-10-8-14(9-11-15)22(24)25/h3-11,16-18,20H,12H2,1-2H3/t16-,17-,18+,20-/m0/s1
InChIKey UWKHUCOPECBJGN-GNBUJSLZSA-N
Literature Reference Author E.BOZO,S.BOROS,J.KUSZMANN
Literature Reference Citation CARBOHYDR.RES.,311,191(1998)
Literature Reference DOI 10.1016/S0008-6215(98)00221-3
Molecular Weight 431.460 g/mol
Solvent CDCl3
Source File Reference UWMZ2910
SpectraBase Batch ID 5RPXs9dH4JO