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(1S,2S,3R,4R,6S)-4-(ACETOXYMETHYL)-6-(4-PHENYL-1H-1,2,3-TRIAZOL-1-YL)-CYCLOHEXANE-1,2,3-TRIYL-TRIACETATE
SpectraBase Compound ID KuxVnXmBth6
InChI InChI=1S/C23H27N3O8/c1-13(27)31-12-18-10-20(26-11-19(24-25-26)17-8-6-5-7-9-17)22(33-15(3)29)23(34-16(4)30)21(18)32-14(2)28/h5-9,11,18,20-23H,10,12H2,1-4H3/t18-,20+,21-,22+,23+/m1/s1
InChIKey XMSPYTWAYXGIJO-GMISPTPDSA-N
Mol Weight 473.48 g/mol
Molecular Formula C23H27N3O8
Exact Mass 473.179815 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5UNYKYvLK0d
Name (1S,2S,3R,4R,6S)-4-(ACETOXYMETHYL)-6-(4-PHENYL-1H-1,2,3-TRIAZOL-1-YL)-CYCLOHEXANE-1,2,3-TRIYL-TRIACETATE
Compound Number 13A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C23H27N3O8
InChI InChI=1S/C23H27N3O8/c1-13(27)31-12-18-10-20(26-11-19(24-25-26)17-8-6-5-7-9-17)22(33-15(3)29)23(34-16(4)30)21(18)32-14(2)28/h5-9,11,18,20-23H,10,12H2,1-4H3/t18-,20+,21-,22+,23+/m1/s1
InChIKey XMSPYTWAYXGIJO-GMISPTPDSA-N
Literature Reference Author L.JI,G.Q.ZHOU,C.QIAN,X.Z.CHEN
Literature Reference Citation EUR.J.ORG.CHEM.,2014,3622(2014)
Literature Reference DOI 10.1002/ejoc.201301874
Molecular Weight 473.483 g/mol
Solvent CDCl3
Source File Reference UWIR18505