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2-Methoxyestradiol

View entire compound with spectra: 2 NMR, 4 FTIR, and 2 Raman

2-Methoxyestradiol
SpectraBase Compound ID 1LH8SGaz02b
InChI InChI=1S/C19H26O3/c1-19-8-7-12-13(15(19)5-6-18(19)21)4-3-11-9-16(20)17(22-2)10-14(11)12/h9-10,12-13,15,18,20-21H,3-8H2,1-2H3/t12-,13+,15-,18-,19-/m0/s1
InChIKey CQOQDQWUFQDJMK-SSTWWWIQSA-N
Mol Weight 302.41 g/mol
Molecular Formula C19H26O3
Exact Mass 302.188195 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 46BZHGDs8sa
Name 2-Methoxyestradiol
Source of Sample Sigma-Aldrich Co. LLC.
Catalog Number 286575
CAS Registry Number 362-07-2
Copyright Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H26O3
InChI InChI=1S/C19H26O3/c1-19-8-7-12-13(15(19)5-6-18(19)21)4-3-11-9-16(20)17(22-2)10-14(11)12/h9-10,12-13,15,18,20-21H,3-8H2,1-2H3/t12-,13+,15-,18-,19-/m0/s1
InChIKey CQOQDQWUFQDJMK-SSTWWWIQSA-N
Observed nucleus 13C
Purity 98%
Solvent CDCl3
Source of Spectrum Sigma-Aldrich Co. LLC.
Synonyms 1,3,5(10)-Estratriene-2,3,17-triol 2-methyl ether 2,3,17beta-Trihydroxy-1,3,5(10)-estratriene 2-methyl ether 2-Hydroxyestradiol 2-methyl ether 2-Methoxyestra-1,3,5(10)-triene-3,17beta-diol 3,17beta-Dihydroxy-2-methoxy-1,3,5(10)-estratriene
Wiley ID SIAL_13CNMR_005423