CID 165362592

Dtxsid901349002

Structural Information

Molecular Formula
C10H3F15O
SMILES
C(=C/C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)\C=O
InChI
InChI=1S/C10H3F15O/c11-4(12,2-1-3-26)5(13,14)6(15,16)7(17,18)8(19,20)9(21,22)10(23,24)25/h1-3H/b2-1+
InChIKey
KMPQUCAHSGTSIB-OWOJBTEDSA-N
Compound name
(E)-4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-pentadecafluorodec-2-enal
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

423.99445 Da
Monoisotopic Mass

5.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 425.00173 180.8
[M+Na]+ 446.98367 161.9
[M-H]- 422.98717 159.3
[M+NH4]+ 442.02827 162.6
[M+K]+ 462.95761 186.1
[M+H-H2O]+ 406.99171 166.4
[M+HCOO]- 468.99265 177.0
[M+CH3COO]- 483.00830 224.6
[M+Na-2H]- 444.96912 183.4
[M]+ 423.99390 153.8
[M]- 423.99500 153.8
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.