CID 2775068

(e)-perfluoro-4-methylpent-2-enoyl fluoride

Structural Information

Molecular Formula
C6F10O
SMILES
C(=C(/C(C(F)(F)F)(C(F)(F)F)F)\F)(\C(=O)F)/F
InChI
InChI=1S/C6F10O/c7-1(3(9)17)2(8)4(10,5(11,12)13)6(14,15)16/b2-1+
InChIKey
ZDDYAQBRMKIGMY-OWOJBTEDSA-N
Compound name
(E)-2,3,4,5,5,5-hexafluoro-4-(trifluoromethyl)pent-2-enoyl fluoride
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

0
Patents

277.97894 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 278.98622 143.1
[M+Na]+ 300.96816 152.2
[M-H]- 276.97166 131.7
[M+NH4]+ 296.01276 158.3
[M+K]+ 316.94210 149.8
[M+H-H2O]+ 260.97620 131.6
[M+HCOO]- 322.97714 149.4
[M+CH3COO]- 336.99279 198.2
[M+Na-2H]- 298.95361 143.3
[M]+ 277.97839 127.1
[M]- 277.97949 127.1
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.