CID 257247

2,2,2-trifluoroethyl perfluorobutanimidate

Structural Information

Molecular Formula
C6H3F10NO
SMILES
C(C(F)(F)F)OC(=N)C(C(C(F)(F)F)(F)F)(F)F
InChI
InChI=1S/C6H3F10NO/c7-3(8,9)1-18-2(17)4(10,11)5(12,13)6(14,15)16/h17H,1H2
InChIKey
MFBCEXYUNWQKLU-UHFFFAOYSA-N
Compound name
2,2,2-trifluoroethyl 2,2,3,3,4,4,4-heptafluorobutanimidate
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

0
Patents

295.0055 Da
Monoisotopic Mass

3.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 296.01278 150.1
[M+Na]+ 317.99472 158.8
[M-H]- 293.99822 138.7
[M+NH4]+ 313.03932 164.5
[M+K]+ 333.96866 156.5
[M+H-H2O]+ 278.00276 138.4
[M+HCOO]- 340.00370 157.4
[M+CH3COO]- 354.01935 202.7
[M+Na-2H]- 315.98017 153.6
[M]+ 295.00495 134.4
[M]- 295.00605 134.4
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

No patent data available for this compound.