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]+ 353.139696 180.2
[M+Na]+ 375.121638 187.1
[M-H]- 351.125144 194.4
[M+NH4]+ 370.166243 194.1
[M+K]+ 391.095578 182.2
[M+H-H2O]+ 335.129680 168.4
[M+HCOO]- 397.130621 211.5
[M+CH3COO]- 411.146271 192.0
[M+Na-2H]- 373.107086 190.7
[M]+ 352.13187142 181.7
[M]- 352.13296858 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.