PubChemLite - Hopas n=5 m=11 (C32H45F21O11)

Structural Information

Molecular Formula

SMILES

C(COCCOCCOCCOCCOCCOCCOCCOCCOCCOCCO)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/C32H45F21O11/c33-23(34,24(35,36)25(37,38)26(39,40)27(41,42)28(43,44)29(45,46)30(47,48)31(49,50)32(51,52)53)1-3-55-5-7-57-9-11-59-13-15-61-17-19-63-21-22-64-20-18-62-16-14-60-12-10-58-8-6-56-4-2-54/h54H,1-22H2

InChIKey

RQUDEQDAMNFULP-UHFFFAOYSA-N

Compound name

2-[2-[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]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]+	1005.2699	255.7
[M+Na]+	1027.2518	252.4
[M-H]-	1003.2554	262.4
[M+NH4]+	1022.2965	269.5
[M+K]+	1043.2258	269.6
[M+H-H2O]+	987.25989	241.7
[M+HCOO]-	1049.2608	266.4
[M+CH3COO]-	1063.2765	299.4
[M+Na-2H]-	1025.2373	245.1
[M]+	1004.2621	258.5
[M]-	1004.2632	258.5

Adduct

m/z

Predicted CCS (Å²)

[M+H]+

1005.2699

255.7

[M+Na]+

1027.2518

252.4

[M-H]-

1003.2554

262.4

[M+NH4]+

1022.2965

269.5

[M+K]+

1043.2258

269.6

[M+H-H2O]+

987.25989

241.7

[M+HCOO]-

1049.2608

266.4

[M+CH3COO]-

1063.2765

299.4

[M+Na-2H]-

1025.2373

245.1

[M]+

1004.2621

258.5

[M]-

1004.2632

258.5

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

Hopas n=5 m=11

Structural Information

2D Structure

Profile

Predicted Collision Cross Section

Literature stripe

Patent stripe