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

4
Patents

194.03032 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 195.037596 133.4
[M+Na]+ 217.019538 142.7
[M-H]- 193.023044 133.1
[M+NH4]+ 212.064143 151.8
[M+K]+ 232.993478 142.5
[M+H-H2O]+ 177.027580 125.2
[M+HCOO]- 239.028521 153.4
[M+CH3COO]- 253.044171 182.1
[M+Na-2H]- 215.004986 139.3
[M]+ 194.02977142 130.9
[M]- 194.03086858 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