For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

Pregn-4-ene-3,20-dione, 6-methyl-16-(1-methylethyl)-, (6.alpha.,16.alpha.)-

View entire compound with spectra: 1 NMR, and 1 MS (GC)

Pregn-4-ene-3,20-dione, 6-methyl-16-(1-methylethyl)-, (6.alpha.,16.alpha.)-
SpectraBase Compound ID JdB92bzkm4T
InChI InChI=1S/C25H38O2/c1-14(2)18-13-22-19-11-15(3)21-12-17(27)7-9-24(21,5)20(19)8-10-25(22,6)23(18)16(4)26/h12,14-15,18-20,22-23H,7-11,13H2,1-6H3
InChIKey FUHICEVRJQTFHR-UHFFFAOYSA-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

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 7aOJ47tRi5h
Name Pregn-4-ene-3,20-dione, 6-methyl-16-(1-methylethyl)-, (6.alpha.,16.alpha.)-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 370.287180462 u
Formula C25H38O2
InChI InChI=1S/C25H38O2/c1-14(2)18-13-22-19-11-15(3)21-12-17(27)7-9-24(21,5)20(19)8-10-25(22,6)23(18)16(4)26/h12,14-15,18-20,22-23H,7-11,13H2,1-6H3
InChIKey FUHICEVRJQTFHR-UHFFFAOYSA-N
Molecular Weight 370.577 g/mol
SMILES C[C@]12[C@]([C@]3([C@](CC2)([C@]2(C)C([C@](C3)(C)[H])=CC(CC2)=O)[H])[H])(C[C@]([C@@]1(C(C)=O)[H])(C(C)C)[H])[H]