D-Carnitine

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Systematic / IUPAC Name: (2S)-3-Carboxy-2-hydroxy-N,N,N-trimethyl-1-propanaminium

ID: Reference6597

Other Names: (S)-Carnitinium;
(2S)-3-Carboxy-2-hydroxy-N,N,N-trimethylpropan-1-aminium;
[(2S)-2,4-Dihydroxy-4-oxobutyl]-trimethylazanium;
(+)-Carnitine

Formula: C7H16NO3 +

Spectral Data

D-Carnitine 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 Fusion Lumos with ETD LBP
No. of Spectral Trees 1
No. of Spectra 240
Tandem Spectra MS1, MS2, MS3
Ionization Methods NSI
Analyzers FT
Last Modification 7/6/2017 12:24:42 PM
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Identificators

InChI InChI=1S/C7H15NO3/c1-8(2,3)5-6(9)4-7(10)11/h6,9H,4-5H2,1-3H3/p+1/t6-/m0/s1
InChI Key PHIQHXFUZVPYII-LURJTMIESA-O
Canonical SMILES C[N+](C)(C)CC(CC(=O)O)O
CAS 541140
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Other Names (S)-Carnitinium;
(2S)-3-Carboxy-2-hydroxy-N,N,N-trimethylpropan-1-aminium;
[(2S)-2,4-Dihydroxy-4-oxobutyl]-trimethylazanium;
(+)-Carnitine

In Other Databases

ChemSpider 141364
Wikipedia Carnitine
ChEBI CHEBI:51453
PubChem 160907
KEGG C15025