CID 44717372

1262414-55-0

Structural Information

Molecular Formula
C4H7F3N2O
SMILES
C(C(C(=O)N)N)C(F)(F)F
InChI
InChI=1S/C4H7F3N2O/c5-4(6,7)1-2(8)3(9)10/h2H,1,8H2,(H2,9,10)
InChIKey
DHDGBSPEABIHLZ-UHFFFAOYSA-N
Compound name
2-amino-4,4,4-trifluorobutanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

23
Patents

156.05104 Da
Monoisotopic Mass

-0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 157.05832 127.5
[M+Na]+ 179.04026 134.2
[M-H]- 155.04376 123.2
[M+NH4]+ 174.08486 147.1
[M+K]+ 195.01420 133.6
[M+H-H2O]+ 139.04830 120.3
[M+HCOO]- 201.04924 146.4
[M+CH3COO]- 215.06489 180.2
[M+Na-2H]- 177.02571 130.2
[M]+ 156.05049 119.3
[M]- 156.05159 119.3
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