CID 79789707

2-amino-n-ethyl-3,3,3-trifluoro-2-methylpropanamide

Structural Information

Molecular Formula
C6H11F3N2O
SMILES
CCNC(=O)C(C)(C(F)(F)F)N
InChI
InChI=1S/C6H11F3N2O/c1-3-11-4(12)5(2,10)6(7,8)9/h3,10H2,1-2H3,(H,11,12)
InChIKey
FDKXRFFAEKVUIO-UHFFFAOYSA-N
Compound name
2-amino-N-ethyl-3,3,3-trifluoro-2-methylpropanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

184.08235 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 185.08963 135.9
[M+Na]+ 207.07157 142.5
[M-H]- 183.07507 132.0
[M+NH4]+ 202.11617 154.9
[M+K]+ 223.04551 141.7
[M+H-H2O]+ 167.07961 129.0
[M+HCOO]- 229.08055 154.2
[M+CH3COO]- 243.09620 185.8
[M+Na-2H]- 205.05702 140.7
[M]+ 184.08180 129.5
[M]- 184.08290 129.5
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.