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Nitrotyrosine
SpectraBase Compound ID 58ZraALtOYa
InChI InChI=1S/C9H10N2O5/c10-6(9(13)14)3-5-1-2-8(12)7(4-5)11(15)16/h1-2,4,6,12H,3,10H2,(H,13,14)/t6-/m0/s1
InChIKey FBTSQILOGYXGMD-LURJTMIESA-N
Mol Weight 226.19 g/mol
Molecular Formula C9H10N2O5
Exact Mass 226.058971 g/mol

Raman Spectrum

Raman Spectrum

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SpectraBase Spectrum ID 6UWQ9KHwyun
Name Nitrotyrosine
Source of Sample Cayman Chemical Company
Catalog Number 89540
Lot Number 0450620-16
Acronyms NT
CAS Registry Number 621-44-3
Cell Type NMR tube
Compound Type Pure
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Formula C9H10N2O5
IUPAC Name 3-Nitro-L-tyrosine
InChI InChI=1S/C9H10N2O5/c10-6(9(13)14)3-5-1-2-8(12)7(4-5)11(15)16/h1-2,4,6,12H,3,10H2,(H,13,14)/t6-/m0/s1
InChIKey FBTSQILOGYXGMD-LURJTMIESA-N
Raman Corrections Referenced to internal white light source; 180 degree backscatter
Raman Laser Power 550 mW
Raman Laser Source Nd:YAG
SMILES OC([C@](Cc1cc(c(cc1)O)N(=O)=O)(N)[H])=O
Scans Performed 4480
Source of Spectrum Forensic Spectral Research
Technique FT-Raman