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L-Histidine:HCl:H2O (<5% D) (13C6)

Catalog Number ACM201740887
CAS 201740-88-7
Synonyms L-Histidine-13C6 hydrochloride monohydrate
IUPAC Name (2S)-2-amino-3-((2,4,5-13C3)1H-imidazol-5-yl)(1,2,3-13C3)propanoic acid;hydrate;hydrochloride
Molecular Weight 215.59
Molecular Formula 13C6H12N3O3Cl
Canonical SMILES [13CH]1=[13C](N[13CH]=N1)[13CH2][13C@@H]([13C](=O)O)N.O.Cl
InChI InChI=1S/C6H9N3O2.ClH.H2O/c7-5(6(10)11)1-4-2-8-3-9-4;;/h2-3,5H,1,7H2,(H,8,9)(H,10,11);1H;1H2/t5-;;/m0../s1/i1+1,2+1,3+1,4+1,5+1,6+1;;
InChI Key CMXXUDSWGMGYLZ-NHMLGGAVSA-N
Melting Point 254 °C (489 °F) (dec.)
Purity 98%
Appearance White crystalline
Isotopic Enrichment 97-99 atom % 13C
pH 3-4 at 105 g/L at 25 °C (77 °F)
Unlabeled CAS 5934-29-2
Unlabeled Synonyms L-α-Amino-β-(4-imidazolyl)propionic acidmonohydrochloride
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