N1-(3-Pyridylmethyl)-2,4-dichloroaniline

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Systematic / IUPAC Name: 2,4-Dichloro-N-(3-pyridinylmethyl)aniline

ID: Reference7071

Other Names: 2,4-Dichloro-N-(pyridin-3-ylmethyl)aniline;
3-Pyridinemethanamine, N-(2,4-dichlorophenyl)-

Formula: C12H10Cl2N2

Spectral Data

N1-(3-Pyridylmethyl)-2,4-dichloroaniline 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 Q Exactive Orbitrap
No. of Spectral Trees 1
No. of Spectra 119
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 11/23/2017 9:42:38 AM
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Identificators

InChI InChI=1S/C12H10Cl2N2/c13-10-3-4-12(11(14)6-10)16-8-9-2-1-5-15-7-9/h1-7,16H,8H2
InChI Key HNQDMSRGKGZQMN-UHFFFAOYSA-N
Canonical SMILES C1=CC(=CN=C1)CNC2=C(C=C(C=C2)Cl)Cl
CAS
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Other Names 2,4-Dichloro-N-(pyridin-3-ylmethyl)aniline;
3-Pyridinemethanamine, N-(2,4-dichlorophenyl)-

In Other Databases

ChemSpider 2083060
ChEMBL CHEMBL1456288
PubChem 2804511