CID 10292

2,4'-diphenyldiamine

Structural Information

Molecular Formula
C12H12N2
SMILES
C1=CC=C(C(=C1)C2=CC=C(C=C2)N)N
InChI
InChI=1S/C12H12N2/c13-10-7-5-9(6-8-10)11-3-1-2-4-12(11)14/h1-8H,13-14H2
InChIKey
RDMFEHLCCOQUMH-UHFFFAOYSA-N
Compound name
2-(4-aminophenyl)aniline
Related CIDs

2D Structure

compound 2d structure
6
Annotation Hits

1
References

1704
Patents

184.10005 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 185.10733 138.9
[M+Na]+ 207.08927 146.7
[M-H]- 183.09277 145.2
[M+NH4]+ 202.13387 157.8
[M+K]+ 223.06321 142.4
[M+H-H2O]+ 167.09731 132.0
[M+HCOO]- 229.09825 164.8
[M+CH3COO]- 243.11390 152.2
[M+Na-2H]- 205.07472 145.4
[M]+ 184.09950 134.7
[M]- 184.10060 134.7
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