CID 6432

Perfluoropropane

Structural Information

Molecular Formula

C₃F₈

SMILES

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

InChI

InChI=1S/C3F8/c4-1(5,2(6,7)8)3(9,10)11

InChIKey

QYSGYZVSCZSLHT-UHFFFAOYSA-N

Compound name

1,1,1,2,2,3,3,3-octafluoropropane

Related CIDs

2D Structure

compound 2d structure

7
Annotation Hits: 1397
References: 35752
Patents: 187.98723 Da
Monoisotopic Mass: 3.1
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]+	188.99451	168.3
[M+Na]+	210.97645	170.6
[M+NH4]+	206.02105	169.1
[M+K]+	226.95039	167.5
[M-H]-	186.97995	160.2
[M+Na-2H]-	208.96190	166.4
[M]+	187.98668	166.0
[M]-	187.98778	166.0

Literature stripe

literature stripe

Patent stripe

patents stripe