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A-Norpregnane, 3,20-dimethyl-, (3.beta.,5.alpha.)-

View entire compound with spectra: 2 NMR, 1 FTIR, and 1 MS (GC)

A-Norpregnane, 3,20-dimethyl-, (3.beta.,5.alpha.)-
SpectraBase Compound ID HV8yeMQp7Rh
InChI InChI=1S/C22H38/c1-14(2)17-8-9-19-16-6-7-18-15(3)10-12-22(18,5)20(16)11-13-21(17,19)4/h14-20H,6-13H2,1-5H3/t15-,16?,17+,18-,19?,20?,21+,22-/m0/s1
InChIKey XOYGNUQVAVHUIY-DXUSBGTQSA-N
Mol Weight 302.5 g/mol
Molecular Formula C22H38
Exact Mass 302.297351 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Dvj5tF4NB2c
Name A-Norpregnane, 3,20-dimethyl-, (3.beta.,5.alpha.)-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 302.297351224 u
Formula C22H38
InChI InChI=1S/C22H38/c1-14(2)17-8-9-19-16-6-7-18-15(3)10-12-22(18,5)20(16)11-13-21(17,19)4/h14-20H,6-13H2,1-5H3/t15-,16?,17+,18-,19?,20?,21+,22-/m0/s1
InChIKey XOYGNUQVAVHUIY-DXUSBGTQSA-N
SMILES [C@@]12(C3C(C4CC[C@@]([C@]4(CC3)C)(C(C)C)[H])CC[C@]2([C@@](C)(CC1)[H])[H])C