CID 23236469

59665-28-0

Structural Information

Molecular Formula
C8HBr2F13
SMILES
C(=C(/C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)\Br)\Br
InChI
InChI=1S/C8HBr2F13/c9-1-2(10)3(11,12)4(13,14)5(15,16)6(17,18)7(19,20)8(21,22)23/h1H/b2-1-
InChIKey
YCJFSPFBPAMUCR-UPHRSURJSA-N
Compound name
(Z)-1,2-dibromo-3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooct-1-ene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

501.82373 Da
Monoisotopic Mass

6.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 502.83101 182.0
[M+Na]+ 524.81295 180.5
[M+NH4]+ 519.85755 181.1
[M+K]+ 540.78689 180.6
[M-H]- 500.81645 179.5
[M+Na-2H]- 522.79840 180.2
[M]+ 501.82318 180.9
[M]- 501.82428 180.9
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.