CID 81680

Phenyl 3-hydroxy-2-naphthoate

Structural Information

Molecular Formula
C17H12O3
SMILES
C1=CC=C(C=C1)OC(=O)C2=CC3=CC=CC=C3C=C2O
InChI
InChI=1S/C17H12O3/c18-16-11-13-7-5-4-6-12(13)10-15(16)17(19)20-14-8-2-1-3-9-14/h1-11,18H
InChIKey
SRMZHGJLSDITLO-UHFFFAOYSA-N
Compound name
phenyl 3-hydroxynaphthalene-2-carboxylate
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

149
Patents

264.07864 Da
Monoisotopic Mass

4.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 265.08592 158.5
[M+Na]+ 287.06786 174.5
[M+NH4]+ 282.11246 167.6
[M+K]+ 303.04180 166.3
[M-H]- 263.07136 163.5
[M+Na-2H]- 285.05331 168.2
[M]+ 264.07809 162.4
[M]- 264.07919 162.4
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