CID 67743

Bis(pentafluoropropionyl) peroxide

Structural Information

Molecular Formula

C₆F₁₀O₄

SMILES

C(=O)(C(C(F)(F)F)(F)F)OOC(=O)C(C(F)(F)F)(F)F

InChI

InChI=1S/C6F10O4/c7-3(8,5(11,12)13)1(17)19-20-2(18)4(9,10)6(14,15)16

InChIKey

NHJFHUKLZMQIHN-UHFFFAOYSA-N

Compound name

2,2,3,3,3-pentafluoropropanoyl 2,2,3,3,3-pentafluoropropaneperoxoate

Related CIDs

2D Structure

compound 2d structure

3
Annotation Hits: 0
References: 1599
Patents: 325.96368 Da
Monoisotopic Mass: 3.8
XlogP (predicted)

Profile

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]+	326.97096	151.8
[M+Na]+	348.95290	161.4
[M-H]-	324.95640	140.7
[M+NH4]+	343.99750	165.2
[M+K]+	364.92684	160.6
[M+H-H2O]+	308.96094	140.5
[M+HCOO]-	370.96188	158.3
[M+CH3COO]-	384.97753	202.3
[M+Na-2H]-	346.93835	154.9
[M]+	325.96313	139.8
[M]-	325.96423	139.8

Literature stripe

literature stripe

Patent stripe

patents stripe