CID 6328633

Silatrane

Structural Information

Molecular Formula

C₆H₁₂NO₃Si

SMILES

C1CO[Si]2OCCN1CCO2

InChI

InChI=1S/C6H12NO3Si/c1-4-8-11-9-5-2-7(1)3-6-10-11/h1-6H2

InChIKey

XBRVPWBNRAPVCC-UHFFFAOYSA-N

Compound name

None

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 37
References: 1545
Patents: 174.05864 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]+	175.06592	114.4
[M+Na]+	197.04786	114.4
[M-H]-	173.05136	114.4
[M+NH4]+	192.09246	114.4
[M+K]+	213.02180	114.5
[M+H-H2O]+	157.05590	114.3
[M+HCOO]-	219.05684	114.4
[M+CH3COO]-	233.07249	114.3
[M+Na-2H]-	195.03331	114.2
[M]+	174.05809	114.4
[M]-	174.05919	114.4

Literature stripe

literature stripe

Patent stripe

patents stripe