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15-ACETYL-AGATHADIOL
SpectraBase Compound ID KvS3wR5UtqY
InChI InChI=1S/C22H36O3/c1-16(11-14-25-18(3)24)7-9-19-17(2)8-10-20-21(4,15-23)12-6-13-22(19,20)5/h11,19-20,23H,2,6-10,12-15H2,1,3-5H3/b16-11+/t19-,20-,21+,22+/m0/s1
InChIKey MIDQJBLRSOCEJR-LCSZQOBJSA-N
Mol Weight 348.5 g/mol
Molecular Formula C22H36O3
Exact Mass 348.266445 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8iwAyVWOiVW
Name 15-ACETYL-AGATHADIOL
Compound Number 12
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H36O3
InChI InChI=1S/C22H36O3/c1-16(11-14-25-18(3)24)7-9-19-17(2)8-10-20-21(4,15-23)12-6-13-22(19,20)5/h11,19-20,23H,2,6-10,12-15H2,1,3-5H3/b16-11+/t19-,20-,21+,22+/m0/s1
InChIKey MIDQJBLRSOCEJR-LCSZQOBJSA-N
Literature Reference Author W.C.SU,J.M.FANG,Y.S.CHENG
Literature Reference Citation PHYTOCHEM.,37,1109(1994)
Literature Reference DOI 10.1016/S0031-9422(00)89538-2
Molecular Weight 348.526 g/mol
Solvent CDCl3
Source File Reference UWLU24010