CID 54698216

Jffldxvlsuwkph-uhfffaoysa-n

Structural Information

Molecular Formula
C14H15FN2O4
SMILES
CN1CC(=C(C1=O)O)C(=O)N(CC2=CC=CC=C2F)OC
InChI
InChI=1S/C14H15FN2O4/c1-16-8-10(12(18)14(16)20)13(19)17(21-2)7-9-5-3-4-6-11(9)15/h3-6,18H,7-8H2,1-2H3
InChIKey
JFFLDXVLSUWKPH-UHFFFAOYSA-N
Compound name
N-[(2-fluorophenyl)methyl]-4-hydroxy-N-methoxy-1-methyl-5-oxo-2H-pyrrole-3-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

294.1016 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 295.10888 163.3
[M+Na]+ 317.09082 171.2
[M-H]- 293.09432 168.1
[M+NH4]+ 312.13542 178.9
[M+K]+ 333.06476 169.3
[M+H-H2O]+ 277.09886 154.8
[M+HCOO]- 339.09980 184.9
[M+CH3COO]- 353.11545 205.0
[M+Na-2H]- 315.07627 162.8
[M]+ 294.10105 165.0
[M]- 294.10215 165.0
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.