CAS Registry Number: 571903-59-8

Name:

Benzonitrile, 3-​(phenylamino)​-
3-​Cyanodiphenylamine 

Chemical Formula: C13H10N2
Exact Mass: 194.08
Molecular Weight: 194.23
m/z: 194.08 (100.0%), 195.09 (14.2%)
Elemental Analysis: C, 80.39; H, 5.19; N, 14.42

InChI: InChI=1S/C18H15N3O2/c22-17(14-9-5-2-6-10-14)15-16(21-12-20-15)18(23)19-11-13-7-3-1-4-8-13/h1-10,12H,11H2,(H,19,23)(H,20,21)
InChIKey: CABGOYIIJVFAFK-UHFFFAOYSA-N
Canonical SMILES : C1=CC=C(C=C1)CNC(=O)C2=C(N=CN2)C(=O)C3=CC=CC=C3

Specification

98%

1. (1) Ackermann, Lutz; Organic Letters 2011, V13(7), P1784-1786 CAPLUS
2. (2) Mederski, Werner; DE 10220048 A1 2003 CAPLUS