PubChemLite - Perfluorotetracosane (C24F50)

Structural Information

Molecular Formula

SMILES

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

InChI

InChI=1S/C24F50/c25-1(26,3(29,30)5(33,34)7(37,38)9(41,42)11(45,46)13(49,50)15(53,54)17(57,58)19(61,62)21(65,66)23(69,70)71)2(27,28)4(31,32)6(35,36)8(39,40)10(43,44)12(47,48)14(51,52)16(55,56)18(59,60)20(63,64)22(67,68)24(72,73)74

InChIKey

AXFFGMPNSZVEDX-UHFFFAOYSA-N

Compound name

1,1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,13,13,14,14,15,15,16,16,17,17,18,18,19,19,20,20,21,21,22,22,23,23,24,24,24-pentacontafluorotetracosane

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]+	1238.9275	286.3
[M+Na]+	1260.9094	286.9
[M-H]-	1236.9129	297.4
[M+NH4]+	1255.9540	293.8
[M+K]+	1276.8834	297.8
[M+H-H2O]+	1220.9175	278.6
[M+HCOO]-	1282.9184	294.2
[M+CH3COO]-	1296.9341	271.6
[M+Na-2H]-	1258.8949	290.4
[M]+	1237.9197	274.3
[M]-	1237.9207	274.3

Adduct

m/z

Predicted CCS (Å²)

[M+H]+

1238.9275

286.3

[M+Na]+

1260.9094

286.9

[M-H]-

1236.9129

297.4

[M+NH4]+

1255.9540

293.8

[M+K]+

1276.8834

297.8

[M+H-H2O]+

1220.9175

278.6

[M+HCOO]-

1282.9184

294.2

[M+CH3COO]-

1296.9341

271.6

[M+Na-2H]-

1258.8949

290.4

[M]+

1237.9197

274.3

[M]-

1237.9207

274.3

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

Perfluorotetracosane

Structural Information

2D Structure

Profile

Predicted Collision Cross Section

Literature stripe

Patent stripe