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17BETA-ACETOXY-7ALPHA-METHYL-3-METHOXY-9,13-ISO-1,3,5(10)-ESTRATRIENE
SpectraBase Compound ID JJhuP0ic3dl
InChI InChI=1S/C22H30O3/c1-13-11-15-12-16(24-4)5-6-17(15)18-9-10-22(3)19(21(13)18)7-8-20(22)25-14(2)23/h5-6,12-13,18-21H,7-11H2,1-4H3/t13-,18+,19+,20+,21-,22-/m0/s1
InChIKey LDGKJIZTBLXXAG-IIDZOKNTSA-N
Mol Weight 342.48 g/mol
Molecular Formula C22H30O3
Exact Mass 342.219495 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7h9FXO5qoFD
Name 17BETA-ACETOXY-7ALPHA-METHYL-3-METHOXY-9,13-ISO-1,3,5(10)-ESTRATRIENE
Comments OR
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Formula C22H30O3
InChI InChI=1S/C22H30O3/c1-13-11-15-12-16(24-4)5-6-17(15)18-9-10-22(3)19(21(13)18)7-8-20(22)25-14(2)23/h5-6,12-13,18-21H,7-11H2,1-4H3/t13-,18+,19+,20+,21-,22-/m0/s1
InChIKey LDGKJIZTBLXXAG-IIDZOKNTSA-N
Instrument Name Tesla BS567A
Literature Reference I.I.ELISEEV, E.A.ZHUKOVSKY, A.G.SHAVVA (1992) Vestnik St.Peterb.Univer.(Russ.Lang.): N2, 67-71.
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3 chloroform-d