CID 74884

2043-52-9

Structural Information

Molecular Formula
C9H4F15I
SMILES
C(CI)C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F
InChI
InChI=1S/C9H4F15I/c10-3(11,1-2-25)4(12,13)5(14,15)6(16,17)7(18,19)8(20,21)9(22,23)24/h1-2H2
InChIKey
QVTHRDRXTVTNEK-UHFFFAOYSA-N
Compound name
1,1,1,2,2,3,3,4,4,5,5,6,6,7,7-pentadecafluoro-9-iodononane
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

8
Patents

523.9118 Da
Monoisotopic Mass

6.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 524.91908 170.7
[M+Na]+ 546.90102 170.3
[M+NH4]+ 541.94562 170.0
[M+K]+ 562.87496 170.1
[M-H]- 522.90452 167.8
[M+Na-2H]- 544.88647 169.4
[M]+ 523.91125 169.7
[M]- 523.91235 169.7
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