CID 32029

Brn 0928748

Structural Information

Molecular Formula
C18H14N2O4
SMILES
COC1=CC=C(C=C1)N=NC2=CC(=C(C3=CC=CC=C32)O)C(=O)O
InChI
InChI=1S/C18H14N2O4/c1-24-12-8-6-11(7-9-12)19-20-16-10-15(18(22)23)17(21)14-5-3-2-4-13(14)16/h2-10,21H,1H3,(H,22,23)
InChIKey
MWCBQCTYQAFFLW-UHFFFAOYSA-N
Compound name
1-hydroxy-4-[(4-methoxyphenyl)diazenyl]naphthalene-2-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

322.09537 Da
Monoisotopic Mass

4.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 323.10265 173.2
[M+Na]+ 345.08459 187.0
[M+NH4]+ 340.12919 180.4
[M+K]+ 361.05853 180.0
[M-H]- 321.08809 178.4
[M+Na-2H]- 343.07004 181.4
[M]+ 322.09482 176.5
[M]- 322.09592 176.5
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.