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3,5-Diiodo-L-tyrosine dihydrate

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

3,5-Diiodo-L-tyrosine dihydrate
SpectraBase Compound ID AeVx1vPQMd2
InChI InChI=1S/C9H9I2NO3.2H2O/c10-5-1-4(2-6(11)8(5)13)3-7(12)9(14)15;;/h1-2,7,13H,3,12H2,(H,14,15);2*1H2/t7-;;/m0../s1
InChIKey YWAGQOOMOOUEGY-KLXURFKVSA-N
Mol Weight 469.014 g/mol
Molecular Formula C9H13I2NO5
Exact Mass 468.888313 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID HvSVc5oPOha
Name 3,5-DIIODO-L-TYROSINE, DIHYDRATE
Source of Sample Fluka AG, Buchs, Switzerland
CAS Registry Number 300-39-0
Copyright Copyright © 1980, 1981-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H9I2NO3 2H2O
InChI InChI=1S/C9H9I2NO3.2H2O/c10-5-1-4(2-6(11)8(5)13)3-7(12)9(14)15;;/h1-2,7,13H,3,12H2,(H,14,15);2*1H2/t7-;;/m0../s1
InChIKey YWAGQOOMOOUEGY-KLXURFKVSA-N
Molecular Weight 469.02
Solvent Deuterium oxide/NaOD; Reference=Dioxane Spectrometer= Varian CFT-20