CID 111552

1-(2,6-xylylazo)-2-naphthol

Structural Information

Molecular Formula
C18H16N2O
SMILES
CC1=C(C(=CC=C1)C)N=NC2=C(C=CC3=CC=CC=C32)O
InChI
InChI=1S/C18H16N2O/c1-12-6-5-7-13(2)17(12)19-20-18-15-9-4-3-8-14(15)10-11-16(18)21/h3-11,21H,1-2H3
InChIKey
ODZLEFHKZFAHHS-UHFFFAOYSA-N
Compound name
1-[(2,6-dimethylphenyl)diazenyl]naphthalen-2-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

276.12625 Da
Monoisotopic Mass

4.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 277.13353 164.4
[M+Na]+ 299.11547 180.7
[M+NH4]+ 294.16007 174.3
[M+K]+ 315.08941 171.0
[M-H]- 275.11897 172.2
[M+Na-2H]- 297.10092 175.1
[M]+ 276.12570 169.2
[M]- 276.12680 169.2
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.