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2-BETA-(2-(4-NITROPHENOXY)-ETHOXY)-CLOVAN-9-ALPHA-OL
SpectraBase Compound ID EZy61zX2O7D
InChI InChI=1S/C23H33NO5/c1-21(2)14-20(23-11-9-19(25)22(3,15-23)10-8-18(21)23)29-13-12-28-17-6-4-16(5-7-17)24(26)27/h4-7,18-20,25H,8-15H2,1-3H3/t18-,19+,20-,22+,23-/m0/s1
InChIKey VVXGFUYPQNOUGS-SSQPMERFSA-N
Mol Weight 403.5 g/mol
Molecular Formula C23H33NO5
Exact Mass 403.235873 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 63iLXiruLeJ
Name 2-BETA-(2-(4-NITROPHENOXY)-ETHOXY)-CLOVAN-9-ALPHA-OL
Compound Number 17
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C23H33NO5
InChI InChI=1S/C23H33NO5/c1-21(2)14-20(23-11-9-19(25)22(3,15-23)10-8-18(21)23)29-13-12-28-17-6-4-16(5-7-17)24(26)27/h4-7,18-20,25H,8-15H2,1-3H3/t18-,19+,20-,22+,23-/m0/s1
InChIKey VVXGFUYPQNOUGS-SSQPMERFSA-N
Literature Reference Author L.SAIZ-URRA,J.C.RACERO,A.J.MARCIAS-SANCHEZ,R.HERNANDEZ-GALAN ,J.R.HANSON,M.PEREZ-
Literature Reference Citation J.AGR.FOOD.CHEM.,57,2420(2009)
Literature Reference DOI 10.1021/jf8033978
Molecular Weight 403.519 g/mol
Sample ID 41757
Solvent CDCl3