Creatine

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Systematic / IUPAC Name: N-Carbamimidoyl-N-methylglycine

ID: Reference357

Other Names: N-Methyl-N-guanylglycine;
(α-Methylguanido)acetic acid;
Glycine, N-(aminoiminomethyl)-N-methyl-;
Methylglycocyamine;
α-Methylguanidino acetic acid ; more

Formula: C4H9N3O2

Class: Endogenous Metabolites

Spectral Data

Creatine 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; Q Exactive Plus Orbitrap
No. of Spectral Trees 3
No. of Spectra 217
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 1/12/2015 1:26:28 PM
View Mass Spec Data > >

Identificators

InChI InChI=1S/C4H9N3O2/c1-7(4(5)6)2-3(8)9/h2H2,1H3,(H3,5,6)(H,8,9)
InChI Key CVSVTCORWBXHQV-UHFFFAOYSA-N
Canonical SMILES CN(CC(=O)O)C(=N)N
CAS 57001
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Other Names N-Methyl-N-guanylglycine;
(α-Methylguanido)acetic acid;
Glycine, N-(aminoiminomethyl)-N-methyl-;
Methylglycocyamine;
α-Methylguanidino acetic acid;
Methylguanidoacetic acid;
2-(1-Methylguanidino)acetic acid;
(N-Methylcarbamimidamido)acetic acid;
N-(Aminoiminomethyl)-N-methylglycine;
2-(1-Methylcarbamimidamido)acetic acid;
2-(Amidinomethylamino)acetic acid;
[[Amino(imino)methyl](methyl)amino]acetic acid;
Methylguanidoacetate;
(α-Methylguanido)acetate;
N-[Amino(imino)methyl]-N-methylglycine;
Creatin;
N-Amidinosarcosine;
Krebiozon;
Pyrolysate;
Phosphagen;
Cosmocair C 100

In Other Databases

PubChem 586
ChemSpider 566
Wikipedia Creatine
ChemIDPlus 000057001; 006020877
HMDb HMDB00064
ChEBI CHEBI:16919; CHEBI:57947
KEGG C00300
ChEMBL CHEMBL283800