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3,17b-Diacetoxy-estra-1,3,5(10)-triene

View entire compound with spectra: 7 NMR, and 4 MS (GC)

3,17b-Diacetoxy-estra-1,3,5(10)-triene
SpectraBase Compound ID ED6BH1wntnS
InChI InChI=1S/C22H28O4/c1-13(23)25-16-5-7-17-15(12-16)4-6-19-18(17)10-11-22(3)20(19)8-9-21(22)26-14(2)24/h5,7,12,18-21H,4,6,8-11H2,1-3H3
InChIKey VQHQLBARMFAKSV-UHFFFAOYSA-N
Mol Weight 356.46 g/mol
Molecular Formula C22H28O4
Exact Mass 356.198759 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID J3bGULpV7QY
Name 3,17-ALPHA-DIACETOXYESTRA-1,3,5(10)-TRIENE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H28O4
InChI InChI=1S/C22H28O4/c1-13(23)25-16-5-7-17-15(12-16)4-6-19-18(17)10-11-22(3)20(19)8-9-21(22)26-14(2)24/h5,7,12,18-21H,4,6,8-11H2,1-3H3
InChIKey VQHQLBARMFAKSV-UHFFFAOYSA-N
Literature Reference Author T.A.WITTSTRUCK,K.I.H.WILLIAMS
Literature Reference Citation J.ORG.CHEM.,38,1542(1973)
Literature Reference DOI 10.1021/jo00948a020
Molecular Weight 356.462 g/mol
Solvent DIOXANE
Source File Reference UNIW11436