CID 37202

35629-41-5

Structural Information

Molecular Formula
C6H5F3N2O2
SMILES
CC(=O)NC1=NC(=CO1)C(F)(F)F
InChI
InChI=1S/C6H5F3N2O2/c1-3(12)10-5-11-4(2-13-5)6(7,8)9/h2H,1H3,(H,10,11,12)
InChIKey
WLBASKRZYJUCTA-UHFFFAOYSA-N
Compound name
N-[4-(trifluoromethyl)-1,3-oxazol-2-yl]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

194.03032 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 195.03760 133.4
[M+Na]+ 217.01954 142.7
[M-H]- 193.02304 133.1
[M+NH4]+ 212.06414 151.8
[M+K]+ 232.99348 142.5
[M+H-H2O]+ 177.02758 125.2
[M+HCOO]- 239.02852 153.4
[M+CH3COO]- 253.04417 182.1
[M+Na-2H]- 215.00499 139.3
[M]+ 194.02977 130.9
[M]- 194.03087 130.9
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

patents stripe