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3.beta.-Acetoxy-17.alpha.-methyl-D-homoandrostane-17A-one

View entire compound with spectra: 1 NMR, and 1 FTIR

3.beta.-Acetoxy-17.alpha.-methyl-D-homoandrostane-17A-one
SpectraBase Compound ID H4SQnI2NgkO
InChI InChI=1S/C23H36O3/c1-14-5-8-19-18-7-6-16-13-17(26-15(2)24)9-11-22(16,3)20(18)10-12-23(19,4)21(14)25/h14,16-20H,5-13H2,1-4H3
InChIKey ZUXRZPAASRGBCR-UHFFFAOYSA-N
Mol Weight 360.5 g/mol
Molecular Formula C23H36O3
Exact Mass 360.266445 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7eO3G07aU4C
Name 3.beta.-Acetoxy-17.alpha.-methyl-D-homoandrostane-17A-one
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 360.266445016 u
Formula C23H36O3
InChI InChI=1S/C23H36O3/c1-14-5-8-19-18-7-6-16-13-17(26-15(2)24)9-11-22(16,3)20(18)10-12-23(19,4)21(14)25/h14,16-20H,5-13H2,1-4H3
InChIKey ZUXRZPAASRGBCR-UHFFFAOYSA-N
Molecular Weight 360.538 g/mol
SMILES C(=O)(OC1CCC2(C(C1)CCC1C2CCC2(C1CCC(C2=O)C)C)C)C