CID 14837368

2-(carboxymethylthio)ethyltrimethylsilane

Structural Information

Molecular Formula
C7H16O2SSi
SMILES
C[Si](C)(C)CCSCC(=O)O
InChI
InChI=1S/C7H16O2SSi/c1-11(2,3)5-4-10-6-7(8)9/h4-6H2,1-3H3,(H,8,9)
InChIKey
WDZDMCOHOFKYKV-UHFFFAOYSA-N
Compound name
2-(2-trimethylsilylethylsulfanyl)acetic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

50
Patents

192.06403 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 193.07131 142.1
[M+Na]+ 215.05325 148.3
[M-H]- 191.05675 140.9
[M+NH4]+ 210.09785 162.2
[M+K]+ 231.02719 146.6
[M+H-H2O]+ 175.06129 137.5
[M+HCOO]- 237.06223 156.3
[M+CH3COO]- 251.07788 178.7
[M+Na-2H]- 213.03870 143.5
[M]+ 192.06348 145.3
[M]- 192.06458 145.3
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe