PubChemLite - Perfluoropentane sulfonic anhydride (C10F22O5S2)

Structural Information

Molecular Formula

SMILES

C(C(C(F)(F)F)(F)F)(C(C(F)(F)S(=O)(=O)OS(=O)(=O)C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F

InChI

InChI=1S/C10F22O5S2/c11-1(12,3(15,16)7(23,24)25)5(19,20)9(29,30)38(33,34)37-39(35,36)10(31,32)6(21,22)2(13,14)4(17,18)8(26,27)28

InChIKey

VDMZJPOIYCDSDW-UHFFFAOYSA-N

Compound name

1,1,2,2,3,3,4,4,5,5,5-undecafluoropentylsulfonyl 1,1,2,2,3,3,4,4,5,5,5-undecafluoropentane-1-sulfonate

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]+	682.89088	193.5
[M+Na]+	704.87282	194.6
[M-H]-	680.87632	203.6
[M+NH4]+	699.91742	206.7
[M+K]+	720.84676	207.5
[M+H-H2O]+	664.88086	180.2
[M+HCOO]-	726.88180	213.1
[M+CH3COO]-	740.89745	252.4
[M+Na-2H]-	702.85827	193.0
[M]+	681.88305	197.7
[M]-	681.88415	197.7

Adduct

m/z

Predicted CCS (Å²)

[M+H]+

682.89088

193.5

[M+Na]+

704.87282

194.6

[M-H]-

680.87632

203.6

[M+NH4]+

699.91742

206.7

[M+K]+

720.84676

207.5

[M+H-H2O]+

664.88086

180.2

[M+HCOO]-

726.88180

213.1

[M+CH3COO]-

740.89745

252.4

[M+Na-2H]-

702.85827

193.0

[M]+

681.88305

197.7

[M]-

681.88415

197.7

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

Perfluoropentane sulfonic anhydride

Structural Information

2D Structure

Profile

Predicted Collision Cross Section

Literature stripe

Patent stripe