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9-Dehydroprogesterone

View entire compound with spectra: 1 NMR, 2 FTIR, and 1 Raman

9-Dehydroprogesterone
SpectraBase Compound ID Jt1GT3MdIzj
InChI InChI=1S/C21H28O2/c1-13(22)17-6-7-18-16-5-4-14-12-15(23)8-10-20(14,2)19(16)9-11-21(17,18)3/h9,12,16-18H,4-8,10-11H2,1-3H3/t16-,17+,18-,20-,21+/m0/s1
InChIKey LCXMRSLFWMMCAS-WRJHFWDFSA-N
Mol Weight 312.45 g/mol
Molecular Formula C21H28O2
Exact Mass 312.20893 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FXfNtlgzVYN
Name PREGNA-4,9(11)-DIEN-3,20-DIONE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H28O2
InChI InChI=1S/C21H28O2/c1-13(22)17-6-7-18-16-5-4-14-12-15(23)8-10-20(14,2)19(16)9-11-21(17,18)3/h9,12,16-18H,4-8,10-11H2,1-3H3/t16-,17+,18-,20-,21+/m0/s1
InChIKey LCXMRSLFWMMCAS-WRJHFWDFSA-N
Literature Reference Author H.L.HOLLAND,E.RIEMLAND
Literature Reference Citation CAN.J.CHEM.,63,1121(1985)
Literature Reference DOI 10.1139/v85-190
Molecular Weight 312.452 g/mol
Solvent CDCl3
Source File Reference UWED5773