CID 15099039

11cl-pf3ouds

Structural Information

Molecular Formula
C10HClF20O4S
SMILES
C(C(C(C(C(F)(F)Cl)(F)F)(F)F)(F)F)(C(C(C(OC(C(F)(F)S(=O)(=O)O)(F)F)(F)F)(F)F)(F)F)(F)F
InChI
InChI=1S/C10HClF20O4S/c11-7(24,25)5(20,21)3(16,17)1(12,13)2(14,15)4(18,19)6(22,23)8(26,27)35-9(28,29)10(30,31)36(32,33)34/h(H,32,33,34)
InChIKey
SZVGIJOITCPDPM-UHFFFAOYSA-N
Compound name
2-(8-chloro-1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8-hexadecafluorooctoxy)-1,1,2,2-tetrafluoroethanesulfonic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

49
Patents

631.8965 Da
Monoisotopic Mass

6.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 632.90378 153.2
[M+Na]+ 654.88572 153.3
[M+NH4]+ 649.93032 153.3
[M+K]+ 670.85966 153.3
[M-H]- 630.88922 153.2
[M+Na-2H]- 652.87117 153.2
[M]+ 631.89595 153.3
[M]- 631.89705 153.3
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe