PubChemLite - Hopas n=3 m=16 (C38H65F13O16)

Structural Information

Molecular Formula

SMILES

C(COCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCO)C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F

InChI

InChI=1S/C38H65F13O16/c39-33(40,34(41,42)35(43,44)36(45,46)37(47,48)38(49,50)51)1-3-53-5-7-55-9-11-57-13-15-59-17-19-61-21-23-63-25-27-65-29-31-67-32-30-66-28-26-64-24-22-62-20-18-60-16-14-58-12-10-56-8-6-54-4-2-52/h52H,1-32H2

InChIKey

LBBDEVCVAXFCPU-UHFFFAOYSA-N

Compound name

2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanol

Related CIDs

2D Structure

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	1025.4138	289.6
[M+Na]+	1047.3957	283.3
[M-H]-	1023.3992	289.4
[M+NH4]+	1042.4403	302.9
[M+K]+	1063.3697	296.8
[M+H-H2O]+	1007.4038	279.3
[M+HCOO]-	1069.4047	296.7
[M+CH3COO]-	1083.4204	309.2
[M+Na-2H]-	1045.3812	270.0
[M]+	1024.4060	295.7
[M]-	1024.4070	295.7

Adduct

m/z

Predicted CCS (Å²)

[M+H]+

1025.4138

289.6

[M+Na]+

1047.3957

283.3

[M-H]-

1023.3992

289.4

[M+NH4]+

1042.4403

302.9

[M+K]+

1063.3697

296.8

[M+H-H2O]+

1007.4038

279.3

[M+HCOO]-

1069.4047

296.7

[M+CH3COO]-

1083.4204

309.2

[M+Na-2H]-

1045.3812

270.0

[M]+

1024.4060

295.7

[M]-

1024.4070

295.7

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.

Hopas n=3 m=16

Structural Information

2D Structure

Profile

Predicted Collision Cross Section

Literature stripe

Patent stripe