2,4,5-Trimethylaniline

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Systematic / IUPAC Name: 2,4,5-Trimethylaniline

ID: Reference8305

Other Names: ψ-Cumidine;
Pseudocumidin;
Pseudocumidine;
1,2,4-Trimethyl-5-aminobenzene;
1-Amino-2,4,5-trimethylbenzene ; more

Formula: C9H13N

Class: Extractables/Leachables Textile Chemicals/Auxiliary/Dyes

Spectral Data

2,4,5-Trimethylaniline 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 with FAIMS
No. of Spectral Trees 1
No. of Spectra 474
Tandem Spectra MS1, MS2, MS3, MS4
Ionization Methods NSI
Analyzers FT
Last Modification 11/13/2018 9:26:28 AM
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Identificators

InChI InChI=1S/C9H13N/c1-6-4-8(3)9(10)5-7(6)2/h4-5H,10H2,1-3H3
InChI Key BMIPMKQAAJKBKP-UHFFFAOYSA-N
Canonical SMILES CC1=CC(=C(C=C1C)N)C
CAS 137177
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Other Names ψ-Cumidine;
Pseudocumidin;
Pseudocumidine;
1,2,4-Trimethyl-5-aminobenzene;
1-Amino-2,4,5-trimethylbenzene;
2,4,5-Trimethylanilin;
2,4,5-Trimethylbenzenamine;
2,4,5-Trimethylphenylamine;
Aniline, 2,4,5-trimethyl-;
Benzenamine, 2,4,5-trimethyl-

In Other Databases

ChemSpider 21106508
PubChem 8717
KEGG C19539
Wikipedia Trimethylaniline (DE)
ChEMBL CHEMBL541229
ChemIDPlus 137177
ChEBI CHEBI:82544