CID 22416

1-naphthalenamine, 4-[(4-aminophenyl)azo]-

Structural Information

Molecular Formula
C16H14N4
SMILES
C1=CC=C2C(=C1)C(=CC=C2N=NC3=CC=C(C=C3)N)N
InChI
InChI=1S/C16H14N4/c17-11-5-7-12(8-6-11)19-20-16-10-9-15(18)13-3-1-2-4-14(13)16/h1-10H,17-18H2
InChIKey
QDPSGELUBXFKSB-UHFFFAOYSA-N
Compound name
4-[(4-aminophenyl)diazenyl]naphthalen-1-amine
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

0
References

914
Patents

262.12186 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 263.129136 156.7
[M+Na]+ 285.111078 164.6
[M-H]- 261.114584 166.4
[M+NH4]+ 280.155683 174.1
[M+K]+ 301.085018 160.0
[M+H-H2O]+ 245.119120 147.7
[M+HCOO]- 307.120061 186.2
[M+CH3COO]- 321.135711 169.5
[M+Na-2H]- 283.096526 165.5
[M]+ 262.12131142 154.8
[M]- 262.12240858 154.8
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe