CID 71347328

2,2,3,3,4,4,4-heptafluoro-n-hydroxy-n-methylbutanamide

Structural Information

Molecular Formula
C5H4F7NO2
SMILES
CN(C(=O)C(C(C(F)(F)F)(F)F)(F)F)O
InChI
InChI=1S/C5H4F7NO2/c1-13(15)2(14)3(6,7)4(8,9)5(10,11)12/h15H,1H3
InChIKey
UBFQJYVHHMWXJH-UHFFFAOYSA-N
Compound name
2,2,3,3,4,4,4-heptafluoro-N-hydroxy-N-methylbutanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

243.01303 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 244.02031 169.4
[M+Na]+ 266.00225 170.7
[M+NH4]+ 261.04685 169.6
[M+K]+ 281.97619 169.1
[M-H]- 242.00575 160.2
[M+Na-2H]- 263.98770 166.8
[M]+ 243.01248 166.4
[M]- 243.01358 166.4
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