α-Methyl-DL-histidine

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Systematic / IUPAC Name: 2-Amino-3-(1H-imidazol-5-yl)-2-methylpropanoic acid

ID: Reference792

Other Names: Histidine, α-methyl-;
N-α-Methylhistidine;
α-Methylhistidine

Formula: C7H11N3O2

Class: Endogenous Metabolites

Spectral Data

α-Methyl-DL-histidine mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

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Available MS Data

Used Instruments Orbitrap Elite
No. of Spectral Trees 2
No. of Spectra 333
Tandem Spectra MS1, MS2, MS3, MS4
Ionization Methods ESI
Analyzers FT
Last Modification 3/10/2015 9:48:21 AM
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Identificators

InChI InChI=1S/C7H11N3O2/c1-7(8,6(11)12)2-5-3-9-4-10-5/h3-4H,2,8H2,1H3,(H,9,10)(H,11,12)
InChI Key HRRYYCWYCMJNGA-UHFFFAOYSA-N
Canonical SMILES CC(CC1=CN=CN1)(C(=O)O)N
CAS 587202
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Other Names Histidine, α-methyl-;
N-α-Methylhistidine;
α-Methylhistidine

In Other Databases

ChEBI CHEBI:70960
ChemSpider 3598122
PubChem 4396761