For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
(+/-)-17-BETA-HYDROXY-3-METHOXY-6-OXA-8-ALPHA-ESTRA-1,3,5(10)-TRIEN-7-ONE
SpectraBase Compound ID CLLZTkJ0yQ6
InChI InChI=1S/C18H22O4/c1-18-8-7-12-11-4-3-10(21-2)9-14(11)22-17(20)16(12)13(18)5-6-15(18)19/h3-4,9,12-13,15-16,19H,5-8H2,1-2H3/t12?,13?,15-,16?,18-/m0/s1
InChIKey PKZYZMZIUSWEDS-WBEFHYNPSA-N
Mol Weight 302.37 g/mol
Molecular Formula C18H22O4
Exact Mass 302.151809 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID GVgpOakjria
Name (+/-)-17-BETA-HYDROXY-3-METHOXY-6-OXA-8-ALPHA-ESTRA-1,3,5(10)-TRIEN-7-ONE
Compound Number 12A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H22O4
InChI InChI=1S/C18H22O4/c1-18-8-7-12-11-4-3-10(21-2)9-14(11)22-17(20)16(12)13(18)5-6-15(18)19/h3-4,9,12-13,15-16,19H,5-8H2,1-2H3/t12?,13?,15-,16?,18-/m0/s1
InChIKey PKZYZMZIUSWEDS-WBEFHYNPSA-N
Literature Reference Author D.J.COLLINS,A.G.JHINGRAN,S.B.RUTSCHMANN
Literature Reference Citation AUSTR.J.CHEM.,42,1769(1989)
Literature Reference DOI 10.1071/ch9891769
Molecular Weight 302.370 g/mol
Solvent DMSO-D6
Source File Reference UWRU8713