CID 5727275

304896-57-9

Structural Information

Molecular Formula
C19H12ClFO2
SMILES
C1=CC(=CC=C1C2=CC=C(O2)/C=C/C(=O)C3=CC=C(C=C3)F)Cl
InChI
InChI=1S/C19H12ClFO2/c20-15-5-1-14(2-6-15)19-12-10-17(23-19)9-11-18(22)13-3-7-16(21)8-4-13/h1-12H/b11-9+
InChIKey
GJZCPUHEVXINRQ-PKNBQFBNSA-N
Compound name
(E)-3-[5-(4-chlorophenyl)furan-2-yl]-1-(4-fluorophenyl)prop-2-en-1-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

326.051 Da
Monoisotopic Mass

5.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 327.05828 175.3
[M+Na]+ 349.04022 191.2
[M+NH4]+ 344.08482 183.5
[M+K]+ 365.01416 183.7
[M-H]- 325.04372 181.3
[M+Na-2H]- 347.02567 184.3
[M]+ 326.05045 179.7
[M]- 326.05155 179.7
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.