CID 68624624

856074-98-1

Structural Information

Molecular Formula
C11H8O4
SMILES
C1=CC2=C(C(=C1)O)C(=C(C=C2)C(=O)O)O
InChI
InChI=1S/C11H8O4/c12-8-3-1-2-6-4-5-7(11(14)15)10(13)9(6)8/h1-5,12-13H,(H,14,15)
InChIKey
XZBCNRVJDCCKBU-UHFFFAOYSA-N
Compound name
1,8-dihydroxynaphthalene-2-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

38
Patents

204.04225 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 205.04953 140.1
[M+Na]+ 227.03147 153.0
[M+NH4]+ 222.07607 147.7
[M+K]+ 243.00541 148.3
[M-H]- 203.03497 140.9
[M+Na-2H]- 225.01692 145.2
[M]+ 204.04170 142.0
[M]- 204.04280 142.0
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