CID 4191623

368889-67-2

Structural Information

Molecular Formula
C12H10FN3O2S
SMILES
C1=CC(=CC=C1CNC(=O)C(=O)NC2=NC=CS2)F
InChI
InChI=1S/C12H10FN3O2S/c13-9-3-1-8(2-4-9)7-15-10(17)11(18)16-12-14-5-6-19-12/h1-6H,7H2,(H,15,17)(H,14,16,18)
InChIKey
KYLUZUQBTDQGCM-UHFFFAOYSA-N
Compound name
N-[(4-fluorophenyl)methyl]-N'-(1,3-thiazol-2-yl)oxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

279.0478 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 280.05508 159.4
[M+Na]+ 302.03702 168.0
[M+NH4]+ 297.08162 165.6
[M+K]+ 318.01096 163.0
[M-H]- 278.04052 160.9
[M+Na-2H]- 300.02247 165.1
[M]+ 279.04725 161.0
[M]- 279.04835 161.0
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.