John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=23rXwEHgaX4 SpectraBase Spectrum ID=2Vv0T1hgbLZ

(accessed ).
N-TETRA-O-ACETYL-BETA-D-MANNOPYRANOSYL-3-PHENYL-THIOCARBAMIDE
SpectraBase Compound ID 23rXwEHgaX4
InChI InChI=1S/C21H26N2O9S/c1-11(24)28-10-16-17(29-12(2)25)18(30-13(3)26)19(31-14(4)27)20(32-16)23-21(33)22-15-8-6-5-7-9-15/h5-9,16-20H,10H2,1-4H3,(H2,22,23,33)/t16-,17-,18+,19+,20-/m1/s1
InChIKey NPAYSBKCNHILNY-SWBPCFCJSA-N
Mol Weight 482.5 g/mol
Molecular Formula C21H26N2O9S
Exact Mass 482.135903 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2Vv0T1hgbLZ
Name N-TETRA-O-ACETYL-BETA-D-MANNOPYRANOSYL-3-PHENYL-THIOCARBAMIDE
Compound Number 3B
Copyright Copyright © 2016-2021 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H26N2O9S
InChI InChI=1S/C21H26N2O9S/c1-11(24)28-10-16-17(29-12(2)25)18(30-13(3)26)19(31-14(4)27)20(32-16)23-21(33)22-15-8-6-5-7-9-15/h5-9,16-20H,10H2,1-4H3,(H2,22,23,33)/t16-,17-,18+,19+,20-/m1/s1
InChIKey NPAYSBKCNHILNY-SWBPCFCJSA-N
Literature Reference Author M.G.DHONDE,A.V.WANKHADE,S.P.DESHMUKH
Literature Reference Citation J.CHEM.PHARM.RES.,2,4,518(2010)
Molecular Weight 482.505 g/mol
Solvent CDCl3
Source File Reference UWIR14282
SpectraBase Batch ID AMAkEfSCb98