CID 3024106

94237-08-8

Structural Information

Molecular Formula

C₁₁H₁₃F₁₃OSi

SMILES

CO[Si](C)(C)CCC(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F

InChI

InChI=1S/C11H13F13OSi/c1-25-26(2,3)5-4-6(12,13)7(14,15)8(16,17)9(18,19)10(20,21)11(22,23)24/h4-5H2,1-3H3

InChIKey

JCXUMXSOKCFWQJ-UHFFFAOYSA-N

Compound name

methoxy-dimethyl-(3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctyl)silane

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 0
References: 36
Patents: 436.0528 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]+	437.060076	186.6
[M+Na]+	459.042018	173.1
[M-H]-	435.045524	170.0
[M+NH4]+	454.086623	174.3
[M+K]+	475.015958	191.8
[M+H-H2O]+	419.050060	173.1
[M+HCOO]-	481.051001	187.8
[M+CH3COO]-	495.066651	227.3
[M+Na-2H]-	457.027466	189.5
[M]+	436.05225142	167.6
[M]-	436.05334858	167.6

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe