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20-(1-HYDROXY-3-BUTEN-1-YL)-3-OXOPREGN-4-ENE
SpectraBase Compound ID AciPDc0Ni5j
InChI InChI=1S/C25H38O2/c1-5-6-23(27)16(2)20-9-10-21-19-8-7-17-15-18(26)11-13-24(17,3)22(19)12-14-25(20,21)4/h5,15-16,19-23,27H,1,6-14H2,2-4H3/t16-,19-,20+,21-,22-,23+,24-,25+/m0/s1
InChIKey KIVHMQYHGAOJBN-HQFCQBCYSA-N
Mol Weight 370.6 g/mol
Molecular Formula C25H38O2
Exact Mass 370.28718 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GWEYwaUOusv
Name 20-(1-HYDROXY-3-BUTEN-1-YL)-3-OXOPREGN-4-ENE
Compound Number 11
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C25H38O2
InChI InChI=1S/C25H38O2/c1-5-6-23(27)16(2)20-9-10-21-19-8-7-17-15-18(26)11-13-24(17,3)22(19)12-14-25(20,21)4/h5,15-16,19-23,27H,1,6-14H2,2-4H3/t16-,19-,20+,21-,22-,23+,24-,25+/m0/s1
InChIKey KIVHMQYHGAOJBN-HQFCQBCYSA-N
Literature Reference Author M.J.LIN,T.P.LOH
Literature Reference Citation J.AM.CHEM.SOC.,125,13042(2003)
Literature Reference DOI 10.1021/ja037410i
Molecular Weight 370.576 g/mol
Sample ID 35212
Solvent CDCl3