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Pregnane, 20,21-epoxy-20-methyl-, (5.alpha.)-
SpectraBase Compound ID LJeHGzExuji
InChI InChI=1S/C22H36O/c1-20-12-5-4-6-15(20)7-8-16-17-9-10-19(22(3)14-23-22)21(17,2)13-11-18(16)20/h15-19H,4-14H2,1-3H3
InChIKey HULJMPLNVCUYGA-UHFFFAOYSA-N
Mol Weight 316.5 g/mol
Molecular Formula C22H36O
Exact Mass 316.276616 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FiqIPZEUsn7
Name Pregnane, 20,21-epoxy-20-methyl-, (5.alpha.)-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 316.276615778 u
Formula C22H36O
InChI InChI=1S/C22H36O/c1-20-12-5-4-6-15(20)7-8-16-17-9-10-19(22(3)14-23-22)21(17,2)13-11-18(16)20/h15-19H,4-14H2,1-3H3
InChIKey HULJMPLNVCUYGA-UHFFFAOYSA-N
Molecular Weight 316.529 g/mol
SMILES C[C@]12[C@]([C@]3([C@](CC2)([C@]2(C)[C@@](CC3)(CCCC2)[H])[H])[H])(CC[C@@]1(C1(C)CO1)[H])[H]