Chlormequat

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Systematic / IUPAC Name: 2-Chloro-N,N,N-trimethylethanaminium

ID: Reference1636

Other Names: 2-Chloroethyltrimethylammonium ion;
Ethanaminium, 2-chloro-N,N,N-trimethyl-;
Chlorcholine;
Chlorocholine

Formula: C5H13ClN+

Class: Pesticides/Herbicides

Spectral Data

Chlormequat 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 ID-X with ETD_Cal Gateshead ; Q Exactive Orbitrap
No. of Spectral Trees 2
No. of Spectra 186
Tandem Spectra MS1, MS2
Ionization Methods ESI; NSI
Analyzers FT
Last Modification 12/2/2014 10:58:01 AM
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Identificators

InChI InChI=1S/C5H13ClN/c1-7(2,3)5-4-6/h4-5H2,1-3H3/q+1
InChI Key JUZXDNPBRPUIOR-UHFFFAOYSA-N
Canonical SMILES C[N+](C)(C)CCCl
CAS 999815
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Other Names 2-Chloroethyltrimethylammonium ion;
Ethanaminium, 2-chloro-N,N,N-trimethyl-;
Chlorcholine;
Chlorocholine

In Other Databases

ChEMBL CHEMBL341956
ChemSpider 13237
Wikipedia Chlormequat
ChemIDPlus 007003896
PubChem 13837
KEGG C18585