CID 3069029

2,2-diethyl-1-thia-3-aza-2-silacyclopentane

Structural Information

Molecular Formula

C₆H₁₅NSSi

SMILES

CC[Si]1(NCCS1)CC

InChI

InChI=1S/C6H15NSSi/c1-3-9(4-2)7-5-6-8-9/h7H,3-6H2,1-2H3

InChIKey

VBEJMTPGXGNJIF-UHFFFAOYSA-N

Compound name

2,2-diethyl-1,3,2-thiazasilolidine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 161.06944 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]+	162.07672	132.9
[M+Na]+	184.05866	139.9
[M-H]-	160.06216	133.5
[M+NH4]+	179.10326	156.6
[M+K]+	200.03260	137.8
[M+H-H2O]+	144.06670	128.1
[M+HCOO]-	206.06764	147.8
[M+CH3COO]-	220.08329	169.9
[M+Na-2H]-	182.04411	134.9
[M]+	161.06889	131.2
[M]-	161.06999	131.2

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.