CID 15401058

76855-57-7

Structural Information

Molecular Formula

C₈H₂₀OSSi

SMILES

CC(C)(C)[Si](C)(C)OCCS

InChI

InChI=1S/C8H20OSSi/c1-8(2,3)11(4,5)9-6-7-10/h10H,6-7H2,1-5H3

InChIKey

PZBCENUAPNTHEM-UHFFFAOYSA-N

Compound name

2-[tert-butyl(dimethyl)silyl]oxyethanethiol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 34
Patents: 192.10042 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]+	193.10770	143.8
[M+Na]+	215.08964	150.6
[M-H]-	191.09314	144.2
[M+NH4]+	210.13424	165.1
[M+K]+	231.06358	149.9
[M+H-H2O]+	175.09768	139.5
[M+HCOO]-	237.09862	158.3
[M+CH3COO]-	251.11427	182.5
[M+Na-2H]-	213.07509	147.0
[M]+	192.09987	148.6
[M]-	192.10097	148.6

Literature stripe

literature stripe

Patent stripe

patents stripe