CID 10487244

N-methyl-4-(trifluoromethyl)-1,3-oxazol-2-amine

Structural Information

Molecular Formula
C5H5F3N2O
SMILES
CNC1=NC(=CO1)C(F)(F)F
InChI
InChI=1S/C5H5F3N2O/c1-9-4-10-3(2-11-4)5(6,7)8/h2H,1H3,(H,9,10)
InChIKey
KLQHVVFXIKZBSL-UHFFFAOYSA-N
Compound name
N-methyl-4-(trifluoromethyl)-1,3-oxazol-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

166.0354 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 167.042676 126.4
[M+Na]+ 189.024618 136.0
[M-H]- 165.028124 126.0
[M+NH4]+ 184.069223 146.0
[M+K]+ 204.998558 135.7
[M+H-H2O]+ 149.032660 118.3
[M+HCOO]- 211.033601 147.2
[M+CH3COO]- 225.049251 177.8
[M+Na-2H]- 187.010066 133.9
[M]+ 166.03485142 123.5
[M]- 166.03594858 123.5
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.