CID 5272182

Schembl28185394

Structural Information

Molecular Formula
C14H8O3
SMILES
C1=CC=C2C(=C1)C3=C(O2)C=C(C=C3)C(=O)C=O
InChI
InChI=1S/C14H8O3/c15-8-12(16)9-5-6-11-10-3-1-2-4-13(10)17-14(11)7-9/h1-8H
InChIKey
FSGIFXXRNVBDFH-UHFFFAOYSA-N
Compound name
2-dibenzofuran-3-yl-2-oxoacetaldehyde
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

1
Patents

224.04735 Da
Monoisotopic Mass

3.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 225.05463 144.3
[M+Na]+ 247.03657 155.5
[M-H]- 223.04007 151.5
[M+NH4]+ 242.08117 165.3
[M+K]+ 263.01051 152.7
[M+H-H2O]+ 207.04461 138.8
[M+HCOO]- 269.04555 168.3
[M+CH3COO]- 283.06120 159.2
[M+Na-2H]- 245.02202 152.6
[M]+ 224.04680 149.4
[M]- 224.04790 149.4
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

No patent data available for this compound.