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16-[(1,3-dimethyl-1H-pyrazol-4-yl)methylene]-3-methoxyestra-1(10),2,4-trien-17-ol
SpectraBase Compound ID 8cgyrf49Orb
InChI InChI=1S/C25H32N2O2/c1-15-18(14-27(3)26-15)11-17-13-23-22-7-5-16-12-19(29-4)6-8-20(16)21(22)9-10-25(23,2)24(17)28/h6,8,11-12,14,21-24,28H,5,7,9-10,13H2,1-4H3/b17-11+
InChIKey MEPYNTVXLJQGPP-GZTJUZNOSA-N
Mol Weight 392.5 g/mol
Molecular Formula C25H32N2O2
Exact Mass 392.246378 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Frr32q4GcqE
Name 16-[(1,3-dimethyl-1H-pyrazol-4-yl)methylene]-3-methoxyestra-1(10),2,4-trien-17-ol
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C25H32N2O2/c1-15-18(14-27(3)26-15)11-17-13-23-22-7-5-16-12-19(29-4)6-8-20(16)21(22)9-10-25(23,2)24(17)28/h6,8,11-12,14,21-24,28H,5,7,9-10,13H2,1-4H3/b17-11+
InChIKey MEPYNTVXLJQGPP-GZTJUZNOSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_32045
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: 1844506; SBI_ID: SBI-032049
Temperature 318 °C