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8,13-DIAZA-3-METHOXYESTRA-1,3,5(10)-TRIEN
SpectraBase Compound ID 6a0Eq1ub8jI
InChI InChI=1S/C16H22N2O/c1-19-13-4-5-14-12(11-13)6-10-18-15(14)7-9-17-8-2-3-16(17)18/h4-5,11,15-16H,2-3,6-10H2,1H3
InChIKey XDZYAXIEADIXLB-UHFFFAOYSA-N
Mol Weight 258.36 g/mol
Molecular Formula C16H22N2O
Exact Mass 258.173213 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AkQm9FGXqAa
Name 8,13-Diaza-3-methoxy-estra-1,3,5(10)-triene
CAS Registry Number 70354-59-5
Comments C8, C12 AND C15 DEUTERATED DERIVATIVES REPORTED AS WELL
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C16H22N2O
InChI InChI=1S/C16H22N2O/c1-19-13-4-5-14-12(11-13)6-10-18-15(14)7-9-17-8-2-3-16(17)18/h4-5,11,15-16H,2-3,6-10H2,1H3
InChIKey XDZYAXIEADIXLB-UHFFFAOYSA-N
Instrument Name Varian CFT-20
Literature Reference C. Verchere, D. Rousselle, C. Viel, Org. Magn. Resonance 11, 395 (1978).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3