CID 458250

1,2-dihydrodibenzofuran-2-carboxylic acid

Structural Information

Molecular Formula
C13H10O3
SMILES
C1C(C=CC2=C1C3=CC=CC=C3O2)C(=O)O
InChI
InChI=1S/C13H10O3/c14-13(15)8-5-6-12-10(7-8)9-3-1-2-4-11(9)16-12/h1-6,8H,7H2,(H,14,15)
InChIKey
NZZPQNAVHGOCBL-UHFFFAOYSA-N
Compound name
1,2-dihydrodibenzofuran-2-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

214.06299 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 215.07027 141.9
[M+Na]+ 237.05221 151.8
[M-H]- 213.05571 147.5
[M+NH4]+ 232.09681 162.7
[M+K]+ 253.02615 149.1
[M+H-H2O]+ 197.06025 136.8
[M+HCOO]- 259.06119 163.1
[M+CH3COO]- 273.07684 156.0
[M+Na-2H]- 235.03766 149.5
[M]+ 214.06244 144.2
[M]- 214.06354 144.2
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

No patent data available for this compound.