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D-Thyroxine

View entire compound with spectra: 2 NMR, 5 FTIR, 1 Raman, and 2 UV-Vis

D-Thyroxine
SpectraBase Compound ID KufgNb8WGqu
InChI InChI=1S/C15H11I4NO4/c16-8-4-7(5-9(17)13(8)21)24-14-10(18)1-6(2-11(14)19)3-12(20)15(22)23/h1-2,4-5,12,21H,3,20H2,(H,22,23)/t12-/m1/s1
InChIKey XUIIKFGFIJCVMT-GFCCVEGCSA-N
Mol Weight 776.87 g/mol
Molecular Formula C15H11I4NO4
Exact Mass 776.686688 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Gve1sUYaSDB
Name D-Thyroxine
Source of Sample Sigma-Aldrich Co. LLC.
Catalog Number T34908
CAS Registry Number 51-49-0
Copyright Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H11I4NO4
InChI InChI=1S/C15H11I4NO4/c16-8-4-7(5-9(17)13(8)21)24-14-10(18)1-6(2-11(14)19)3-12(20)15(22)23/h1-2,4-5,12,21H,3,20H2,(H,22,23)/t12-/m1/s1
InChIKey XUIIKFGFIJCVMT-GFCCVEGCSA-N
Observed nucleus 13C
Purity 99%
Solvent DMSO-d6
Source of Spectrum Sigma-Aldrich Co. LLC.
Synonyms 3,3',5,5'-Tetraiodo-D-thyronine 3-[4-(4-Hydroxy-3,5-diiodophenoxy)-3,5-diiodophenyl]-D-alanine
Wiley ID SIAL_13CNMR_012827