CID 156233

71964-75-5

Structural Information

Molecular Formula
C19H14O4
SMILES
COC1=CC2=C(C=C1)C=C(C=C2)C(=O)C3=CC=CC=C3C(=O)O
InChI
InChI=1S/C19H14O4/c1-23-15-9-8-12-10-14(7-6-13(12)11-15)18(20)16-4-2-3-5-17(16)19(21)22/h2-11H,1H3,(H,21,22)
InChIKey
MPMPJSOCGXBPOL-UHFFFAOYSA-N
Compound name
2-(6-methoxynaphthalene-2-carbonyl)benzoic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

306.0892 Da
Monoisotopic Mass

4.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 307.09648 168.5
[M+Na]+ 329.07842 176.1
[M-H]- 305.08192 175.1
[M+NH4]+ 324.12302 183.2
[M+K]+ 345.05236 172.1
[M+H-H2O]+ 289.08646 160.5
[M+HCOO]- 351.08740 188.5
[M+CH3COO]- 365.10305 204.3
[M+Na-2H]- 327.06387 172.2
[M]+ 306.08865 170.4
[M]- 306.08975 170.4
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