CID 10333943

742063-29-2

Structural Information

Molecular Formula

C₆H₄F₁₀O

SMILES

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

InChI

InChI=1S/C6H4F10O/c7-2(8)5(13,14)6(15,16)4(11,12)1-17-3(9)10/h2-3H,1H2

InChIKey

GGMPBPONEOPDTJ-UHFFFAOYSA-N

Compound name

5-(difluoromethoxy)-1,1,2,2,3,3,4,4-octafluoropentane

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 4
Patents: 282.01025 Da
Monoisotopic Mass: 3.9
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]+	283.01753	147.5
[M+Na]+	304.99947	156.0
[M-H]-	281.00297	135.7
[M+NH4]+	300.04407	162.5
[M+K]+	320.97341	154.2
[M+H-H2O]+	265.00751	135.5
[M+HCOO]-	327.00845	154.2
[M+CH3COO]-	341.02410	201.3
[M+Na-2H]-	302.98492	148.5
[M]+	282.00970	133.6
[M]-	282.01080	133.6

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe