CID 139597202

Hopas n=5 m=9

Structural Information

Molecular Formula
C28H37F21O9
SMILES
C(COCCOCCOCCOCCOCCOCCOCCOCCO)C(C(C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F
InChI
InChI=1S/C28H37F21O9/c29-19(30,1-3-51-5-7-53-9-11-55-13-15-57-17-18-58-16-14-56-12-10-54-8-6-52-4-2-50)20(31,32)21(33,34)22(35,36)23(37,38)24(39,40)25(41,42)26(43,44)27(45,46)28(47,48)49/h50H,1-18H2
InChIKey
TUGVKYMLZWZEBQ-UHFFFAOYSA-N
Compound name
2-[2-[2-[2-[2-[2-[2-[2-(3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,12-henicosafluorododecoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

916.2102 Da
Monoisotopic Mass

5.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 917.21748 153.2
[M+Na]+ 939.19942 153.2
[M+NH4]+ 934.24402 153.3
[M+K]+ 955.17336 153.2
[M-H]- 915.20292 153.2
[M+Na-2H]- 937.18487 153.2
[M]+ 916.20965 153.2
[M]- 916.21075 153.2
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.