CID 4401813

4-hydroxy-5-methoxy-1-phenyl-2-naphthoic acid

Structural Information

Molecular Formula
C18H14O4
SMILES
COC1=CC=CC2=C(C(=CC(=C21)O)C(=O)O)C3=CC=CC=C3
InChI
InChI=1S/C18H14O4/c1-22-15-9-5-8-12-16(11-6-3-2-4-7-11)13(18(20)21)10-14(19)17(12)15/h2-10,19H,1H3,(H,20,21)
InChIKey
GTALHGSRIPHFRL-UHFFFAOYSA-N
Compound name
4-hydroxy-5-methoxy-1-phenylnaphthalene-2-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

294.0892 Da
Monoisotopic Mass

3.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 295.09648 166.2
[M+Na]+ 317.07842 181.6
[M+NH4]+ 312.12302 174.2
[M+K]+ 333.05236 174.5
[M-H]- 293.08192 170.3
[M+Na-2H]- 315.06387 174.1
[M]+ 294.08865 169.6
[M]- 294.08975 169.6
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