CID 22830

6358-53-8

Structural Information

Molecular Formula
C18H16N2O3
SMILES
COC1=CC(=C(C=C1)OC)N=NC2=C(C=CC3=CC=CC=C32)O
InChI
InChI=1S/C18H16N2O3/c1-22-13-8-10-17(23-2)15(11-13)19-20-18-14-6-4-3-5-12(14)7-9-16(18)21/h3-11,21H,1-2H3
InChIKey
GJUABKCEXOMRPQ-UHFFFAOYSA-N
Compound name
1-[(2,5-dimethoxyphenyl)diazenyl]naphthalen-2-ol
Related CIDs

2D Structure

compound 2d structure
7
Annotation Hits

5
References

1719
Patents

308.1161 Da
Monoisotopic Mass

4.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 309.12338 169.2
[M+Na]+ 331.10532 177.8
[M-H]- 307.10882 178.7
[M+NH4]+ 326.14992 185.3
[M+K]+ 347.07926 174.6
[M+H-H2O]+ 291.11336 160.0
[M+HCOO]- 353.11430 196.2
[M+CH3COO]- 367.12995 213.6
[M+Na-2H]- 329.09077 176.8
[M]+ 308.11555 173.8
[M]- 308.11665 173.8
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

No patent data available for this compound.