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Details

Stereochemistry ACHIRAL
Molecular Formula C14H19N
Molecular Weight 201.3074
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of (4-(1,1-DIMETHYLETHYL)-2,6-DIMETHYLPHENYL)ACETONITRILE

SMILES

CC1=CC(=CC(C)=C1CC#N)C(C)(C)C

InChI

InChIKey=ZUXNULGHCOXCFL-UHFFFAOYSA-N
InChI=1S/C14H19N/c1-10-8-12(14(3,4)5)9-11(2)13(10)6-7-15/h8-9H,6H2,1-5H3

HIDE SMILES / InChI

Approval Year

Name Type Language
(4-(1,1-DIMETHYLETHYL)-2,6-DIMETHYLPHENYL)ACETONITRILE
Systematic Name English
XYLOMETAZOLINE HYDROCHLORIDE IMPURITY C [EP IMPURITY]
Preferred Name English
4-TERT-BUTYL-2,6-DIMETHYLPHENYLACETONITRILE
Systematic Name English
BENZENEACETONITRILE, 4-(1,1-DIMETHYLETHYL)-2,6-DIMETHYL-
Systematic Name English
Code System Code Type Description
PUBCHEM
1547137
Created by admin on Wed Apr 02 12:32:02 GMT 2025 , Edited by admin on Wed Apr 02 12:32:02 GMT 2025
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EPA CompTox
DTXSID5074680
Created by admin on Wed Apr 02 12:32:02 GMT 2025 , Edited by admin on Wed Apr 02 12:32:02 GMT 2025
PRIMARY
ECHA (EC/EINECS)
284-183-4
Created by admin on Wed Apr 02 12:32:02 GMT 2025 , Edited by admin on Wed Apr 02 12:32:02 GMT 2025
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CAS
84803-57-6
Created by admin on Wed Apr 02 12:32:02 GMT 2025 , Edited by admin on Wed Apr 02 12:32:02 GMT 2025
PRIMARY
FDA UNII
AJ7BNY9HL7
Created by admin on Wed Apr 02 12:32:02 GMT 2025 , Edited by admin on Wed Apr 02 12:32:02 GMT 2025
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