CID 960559

5-(2-fluorophenyl)furan-2-carbaldehyde

Structural Information

Molecular Formula
C11H7FO2
SMILES
C1=CC=C(C(=C1)C2=CC=C(O2)C=O)F
InChI
InChI=1S/C11H7FO2/c12-10-4-2-1-3-9(10)11-6-5-8(7-13)14-11/h1-7H
InChIKey
KGGOAPVMWNGAQS-UHFFFAOYSA-N
Compound name
5-(2-fluorophenyl)furan-2-carbaldehyde
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

22
Patents

190.04301 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 191.05029 134.8
[M+Na]+ 213.03223 145.1
[M-H]- 189.03573 141.8
[M+NH4]+ 208.07683 155.2
[M+K]+ 229.00617 143.1
[M+H-H2O]+ 173.04027 128.3
[M+HCOO]- 235.04121 159.8
[M+CH3COO]- 249.05686 181.0
[M+Na-2H]- 211.01768 141.1
[M]+ 190.04246 136.2
[M]- 190.04356 136.2
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe