CID 5273945

83355-89-9

Structural Information

Molecular Formula

C₁₁H₁₆N₂O₂Si

SMILES

COC1=NC(=NC=C1C#C[Si](C)(C)C)OC

InChI

InChI=1S/C11H16N2O2Si/c1-14-10-9(6-7-16(3,4)5)8-12-11(13-10)15-2/h8H,1-5H3

InChIKey

PANGXXUVOCXPSU-UHFFFAOYSA-N

Compound name

2-(2,4-dimethoxypyrimidin-5-yl)ethynyl-trimethylsilane

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 21
Patents: 236.0981 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]+	237.10538	150.5
[M+Na]+	259.08732	160.6
[M-H]-	235.09082	149.8
[M+NH4]+	254.13192	164.7
[M+K]+	275.06126	158.2
[M+H-H2O]+	219.09536	137.0
[M+HCOO]-	281.09630	164.6
[M+CH3COO]-	295.11195	196.8
[M+Na-2H]-	257.07277	155.1
[M]+	236.09755	148.7
[M]-	236.09865	148.7

Literature stripe

literature stripe

Patent stripe

patents stripe