CID 75371

N,n-diphenyl-p-phenylenediamine

Structural Information

Molecular Formula
C18H16N2
SMILES
C1=CC=C(C=C1)N(C2=CC=CC=C2)C3=CC=C(C=C3)N
InChI
InChI=1S/C18H16N2/c19-15-11-13-18(14-12-15)20(16-7-3-1-4-8-16)17-9-5-2-6-10-17/h1-14H,19H2
InChIKey
UXKQNCDDHDBAPD-UHFFFAOYSA-N
Compound name
4-N,4-N-diphenylbenzene-1,4-diamine
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

8
References

9393
Patents

260.13135 Da
Monoisotopic Mass

5.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 261.13863 159.6
[M+Na]+ 283.12057 165.2
[M-H]- 259.12407 169.9
[M+NH4]+ 278.16517 175.3
[M+K]+ 299.09451 160.5
[M+H-H2O]+ 243.12861 150.3
[M+HCOO]- 305.12955 185.8
[M+CH3COO]- 319.14520 171.6
[M+Na-2H]- 281.10602 166.5
[M]+ 260.13080 156.7
[M]- 260.13190 156.7
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe