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3-Methoxy-1,3,5(10)-estratrien-16a-thiol

View entire compound with spectra: 1 NMR

3-Methoxy-1,3,5(10)-estratrien-16a-thiol
SpectraBase Compound ID IEmnVenNoVy
InChI InChI=1S/C19H26OS/c1-19-8-7-16-15-6-4-13(20-2)9-12(15)3-5-17(16)18(19)10-14(21)11-19/h4,6,9,14,16-18,21H,3,5,7-8,10-11H2,1-2H3
InChIKey BSIAFACHZULPSA-UHFFFAOYSA-N
Mol Weight 302.48 g/mol
Molecular Formula C19H26OS
Exact Mass 302.170437 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2pI1AkmjQYp
Name 3-Methoxy-1,3,5(10)-estratrien-16a-thiol
CAS Registry Number 66880-35-1
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C19H26OS
InChI InChI=1S/C19H26OS/c1-19-8-7-16-15-6-4-13(20-2)9-12(15)3-5-17(16)18(19)10-14(21)11-19/h4,6,9,14,16-18,21H,3,5,7-8,10-11H2,1-2H3
InChIKey BSIAFACHZULPSA-UHFFFAOYSA-N
Instrument Name Jeol PFT-100
Literature Reference G. Engelhardt, D. Zeigan, B. Schoenecker, Org. Magn. Resonance 12, 628 (1979).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3