CID 104676

54023-77-7

Structural Information

Molecular Formula
C17H13NO3
SMILES
C1=CC=C2C=C(C(=CC2=C1)C(=O)NC3=CC(=CC=C3)O)O
InChI
InChI=1S/C17H13NO3/c19-14-7-3-6-13(10-14)18-17(21)15-8-11-4-1-2-5-12(11)9-16(15)20/h1-10,19-20H,(H,18,21)
InChIKey
ZLPDIQADHBAPKL-UHFFFAOYSA-N
Compound name
3-hydroxy-N-(3-hydroxyphenyl)naphthalene-2-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

279.08954 Da
Monoisotopic Mass

4.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 280.09682 161.2
[M+Na]+ 302.07876 168.7
[M-H]- 278.08226 166.7
[M+NH4]+ 297.12336 176.4
[M+K]+ 318.05270 163.6
[M+H-H2O]+ 262.08680 153.7
[M+HCOO]- 324.08774 182.1
[M+CH3COO]- 338.10339 198.1
[M+Na-2H]- 300.06421 167.2
[M]+ 279.08899 159.8
[M]- 279.09009 159.8
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

patents stripe