CID 12595486

2'-amino-p-terphenyl

Structural Information

Molecular Formula

C₁₈H₁₅N

SMILES

C1=CC=C(C=C1)C2=CC(=C(C=C2)C3=CC=CC=C3)N

InChI

InChI=1S/C18H15N/c19-18-13-16(14-7-3-1-4-8-14)11-12-17(18)15-9-5-2-6-10-15/h1-13H,19H2

InChIKey

NCLGCNZJCGGRIX-UHFFFAOYSA-N

Compound name

2,5-diphenylaniline

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 102
Patents: 245.12045 Da
Monoisotopic Mass: 4.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	246.12773	156.1
[M+Na]+	268.10967	163.5
[M-H]-	244.11317	165.5
[M+NH4]+	263.15427	172.5
[M+K]+	284.08361	157.5
[M+H-H2O]+	228.11771	147.6
[M+HCOO]-	290.11865	180.9
[M+CH3COO]-	304.13430	168.6
[M+Na-2H]-	266.09512	162.5
[M]+	245.11990	153.1
[M]-	245.12100	153.1

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe