CID 17959832

(isocyanatomethyl)(dimethoxy)methylsilane

Structural Information

Molecular Formula

C₅H₁₁NO₃Si

SMILES

CO[Si](C)(CN=C=O)OC

InChI

InChI=1S/C5H11NO3Si/c1-8-10(3,9-2)5-6-4-7/h5H2,1-3H3

InChIKey

HENJUOQEQGBPSV-UHFFFAOYSA-N

Compound name

isocyanatomethyl-dimethoxy-methylsilane

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 2331
Patents: 161.05083 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]+	162.05811	129.9
[M+Na]+	184.04005	137.7
[M-H]-	160.04355	131.8
[M+NH4]+	179.08465	151.9
[M+K]+	200.01399	138.9
[M+H-H2O]+	144.04809	125.1
[M+HCOO]-	206.04903	155.8
[M+CH3COO]-	220.06468	178.6
[M+Na-2H]-	182.02550	138.4
[M]+	161.05028	134.8
[M]-	161.05138	134.8

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe