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ETHYL-(22-E)-DE-A,B-8-HYDROXYCHOL-22-EN-24-ATE
SpectraBase Compound ID 3kk4DSdJ8qM
InChI InChI=1S/C17H28O3/c1-4-20-16(19)10-7-12(2)13-8-9-14-15(18)6-5-11-17(13,14)3/h7,10,12-15,18H,4-6,8-9,11H2,1-3H3/b10-7+/t12-,13-,14+,15+,17-/m1/s1
InChIKey CSCUJPIKRQVIJC-XJLUWEFLSA-N
Mol Weight 280.41 g/mol
Molecular Formula C17H28O3
Exact Mass 280.203845 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EtXuAWN2oe
Name ETHYL-(22-E)-DE-A,B-8-HYDROXYCHOL-22-EN-24-ATE
Compound Number 3A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C17H28O3
InChI InChI=1S/C17H28O3/c1-4-20-16(19)10-7-12(2)13-8-9-14-15(18)6-5-11-17(13,14)3/h7,10,12-15,18H,4-6,8-9,11H2,1-3H3/b10-7+/t12-,13-,14+,15+,17-/m1/s1
InChIKey CSCUJPIKRQVIJC-XJLUWEFLSA-N
Literature Reference Author E.MOMAN,D.NICOLETTI,A.MOURINO
Literature Reference Citation ORG.LETTERS,8,1249(2006)
Literature Reference DOI 10.1021/ol060231w
Molecular Weight 280.408 g/mol
Sample ID 39981
Solvent CDCl3