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5-Pregnen-3.beta.-ol-20-one, o-methyloxime

View entire compound with spectra: 1 NMR

5-Pregnen-3.beta.-ol-20-one, o-methyloxime
SpectraBase Compound ID AG6eeGwn7qo
InChI InChI=1S/C22H35NO2/c1-14(23-25-4)18-7-8-19-17-6-5-15-13-16(24)9-11-21(15,2)20(17)10-12-22(18,19)3/h5,16-20,24H,6-13H2,1-4H3/b23-14+
InChIKey KKWPHPAMYMPJIV-OEAKJJBVSA-N
Mol Weight 345.5 g/mol
Molecular Formula C22H35NO2
Exact Mass 345.266779 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FPro9ri7tH6
Name 5-Pregnen-3.beta.-ol-20-one, o-methyloxime
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 345.266779369 u
Formula C22H35NO2
InChI InChI=1S/C22H35NO2/c1-14(23-25-4)18-7-8-19-17-6-5-15-13-16(24)9-11-21(15,2)20(17)10-12-22(18,19)3/h5,16-20,24H,6-13H2,1-4H3/b23-14+
InChIKey KKWPHPAMYMPJIV-OEAKJJBVSA-N
Molecular Weight 345.527 g/mol
SMILES C12(CCC(CC2=CCC2C1CCC1(C2CCC1\C(C)=N\OC)C)O)C