CID 77214

1-naphthalenol, 4-(phenylazo)-

Structural Information

Molecular Formula
C16H12N2O
SMILES
C1=CC=C(C=C1)N=NC2=CC=C(C3=CC=CC=C32)O
InChI
InChI=1S/C16H12N2O/c19-16-11-10-15(13-8-4-5-9-14(13)16)18-17-12-6-2-1-3-7-12/h1-11,19H
InChIKey
CQYDCXNJLAOBIF-UHFFFAOYSA-N
Compound name
4-phenyldiazenylnaphthalen-1-ol
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

1
References

46
Patents

248.09496 Da
Monoisotopic Mass

4.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 249.102236 152.7
[M+Na]+ 271.084178 160.8
[M-H]- 247.087684 161.9
[M+NH4]+ 266.128783 170.9
[M+K]+ 287.058118 156.4
[M+H-H2O]+ 231.092220 144.2
[M+HCOO]- 293.093161 180.2
[M+CH3COO]- 307.108811 166.0
[M+Na-2H]- 269.069626 162.9
[M]+ 248.09441142 153.1
[M]- 248.09550858 153.1
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