CID 24212565

853312-69-3

Structural Information

Molecular Formula
C19H15ClFNO2
SMILES
C1=CC(=CC(=C1)Cl)C2=CC=C(O2)CCC(=O)NC3=CC=C(C=C3)F
InChI
InChI=1S/C19H15ClFNO2/c20-14-3-1-2-13(12-14)18-10-8-17(24-18)9-11-19(23)22-16-6-4-15(21)5-7-16/h1-8,10,12H,9,11H2,(H,22,23)
InChIKey
OIWGTJAFEJDXAN-UHFFFAOYSA-N
Compound name
3-[5-(3-chlorophenyl)furan-2-yl]-N-(4-fluorophenyl)propanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

343.07755 Da
Monoisotopic Mass

4.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 344.084826 180.1
[M+Na]+ 366.066768 188.7
[M-H]- 342.070274 189.4
[M+NH4]+ 361.111373 194.3
[M+K]+ 382.040708 182.8
[M+H-H2O]+ 326.074810 171.5
[M+HCOO]- 388.075751 198.9
[M+CH3COO]- 402.091401 191.6
[M+Na-2H]- 364.052216 181.7
[M]+ 343.07700142 183.1
[M]- 343.07809858 183.1
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.