CID 12736516

62012-20-8

Structural Information

Molecular Formula

SMILES

C[Si](C)(C)C1CC(=O)C1

InChI

InChI=1S/C7H14OSi/c1-9(2,3)7-4-6(8)5-7/h7H,4-5H2,1-3H3

InChIKey

QHTGYXFAZSLMSE-UHFFFAOYSA-N

Compound name

3-trimethylsilylcyclobutan-1-one

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 1
Patents: 142.08139 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]+	143.08867	126.2
[M+Na]+	165.07061	132.7
[M-H]-	141.07411	130.0
[M+NH4]+	160.11521	142.3
[M+K]+	181.04455	135.1
[M+H-H2O]+	125.07865	117.3
[M+HCOO]-	187.07959	146.6
[M+CH3COO]-	201.09524	177.5
[M+Na-2H]-	163.05606	132.0
[M]+	142.08084	134.7
[M]-	142.08194	134.7

Literature stripe

literature stripe

Patent stripe

patents stripe