CID 59112328

Schembl14265432

Structural Information

Molecular Formula

C₈H₁₄ClF₅Si

SMILES

CC[Si](CC)(CCC(C(F)(F)F)(F)F)Cl

InChI

InChI=1S/C8H14ClF5Si/c1-3-15(9,4-2)6-5-7(10,11)8(12,13)14/h3-6H2,1-2H3

InChIKey

YQQDGQBNCALMBX-UHFFFAOYSA-N

Compound name

chloro-diethyl-(3,3,4,4,4-pentafluorobutyl)silane

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 0
References: 2
Patents: 268.04733 Da
Monoisotopic Mass: None
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]+	269.05461	151.1
[M+Na]+	291.03655	159.4
[M-H]-	267.04005	144.9
[M+NH4]+	286.08115	169.2
[M+K]+	307.01049	155.3
[M+H-H2O]+	251.04459	143.7
[M+HCOO]-	313.04553	159.4
[M+CH3COO]-	327.06118	195.2
[M+Na-2H]-	289.02200	155.3
[M]+	268.04678	147.2
[M]-	268.04788	147.2

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe