CID 79175

1-naphthalenol, 2,4-bis(2-phenyldiazenyl)-

Structural Information

Molecular Formula
C22H16N4O
SMILES
C1=CC=C(C=C1)N=NC2=CC(=C(C3=CC=CC=C32)O)N=NC4=CC=CC=C4
InChI
InChI=1S/C22H16N4O/c27-22-19-14-8-7-13-18(19)20(25-23-16-9-3-1-4-10-16)15-21(22)26-24-17-11-5-2-6-12-17/h1-15,27H
InChIKey
TVQPHPSPJUOLGS-UHFFFAOYSA-N
Compound name
2,4-bis(phenyldiazenyl)naphthalen-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

352.13242 Da
Monoisotopic Mass

6.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 353.13970 180.2
[M+Na]+ 375.12164 187.1
[M-H]- 351.12514 194.4
[M+NH4]+ 370.16624 194.1
[M+K]+ 391.09558 182.2
[M+H-H2O]+ 335.12968 168.4
[M+HCOO]- 397.13062 211.5
[M+CH3COO]- 411.14627 192.0
[M+Na-2H]- 373.10709 190.7
[M]+ 352.13187 181.7
[M]- 352.13297 181.7
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

No patent data available for this compound.