CID 531893

313372-22-4

Structural Information

Molecular Formula
C11H8FNO2
SMILES
C1=COC(=C1)C(=O)NC2=CC=C(C=C2)F
InChI
InChI=1S/C11H8FNO2/c12-8-3-5-9(6-4-8)13-11(14)10-2-1-7-15-10/h1-7H,(H,13,14)
InChIKey
AQQZKDFBNBVLHX-UHFFFAOYSA-N
Compound name
N-(4-fluorophenyl)furan-2-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

4
References

4
Patents

205.05391 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 206.061186 140.6
[M+Na]+ 228.043128 148.7
[M-H]- 204.046634 147.2
[M+NH4]+ 223.087733 159.6
[M+K]+ 244.017068 147.0
[M+H-H2O]+ 188.051170 133.2
[M+HCOO]- 250.052111 165.5
[M+CH3COO]- 264.067761 184.9
[M+Na-2H]- 226.028576 146.5
[M]+ 205.05336142 140.1
[M]- 205.05445858 140.1
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