CID 2760863

3-(trimethylsilyl)propiolic acid

Structural Information

Molecular Formula

C₆H₁₀O₂Si

SMILES

C[Si](C)(C)C#CC(=O)O

InChI

InChI=1S/C6H10O2Si/c1-9(2,3)5-4-6(7)8/h1-3H3,(H,7,8)

InChIKey

IPEATTYBFBRNEB-UHFFFAOYSA-N

Compound name

3-trimethylsilylprop-2-ynoic acid

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 320
Patents: 142.04501 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]+	143.05229	130.5
[M+Na]+	165.03423	139.8
[M-H]-	141.03773	129.4
[M+NH4]+	160.07883	149.9
[M+K]+	181.00817	138.6
[M+H-H2O]+	125.04227	120.9
[M+HCOO]-	187.04321	145.4
[M+CH3COO]-	201.05886	178.2
[M+Na-2H]-	163.01968	135.0
[M]+	142.04446	125.3
[M]-	142.04556	125.3

Literature stripe

literature stripe

Patent stripe

patents stripe