CID 116406131

2-(2,2-dimethylthiomorpholin-4-yl)-n-(2-hydroxyethyl)acetamide

Structural Information

Molecular Formula
C10H20N2O2S
SMILES
CC1(CN(CCS1)CC(=O)NCCO)C
InChI
InChI=1S/C10H20N2O2S/c1-10(2)8-12(4-6-15-10)7-9(14)11-3-5-13/h13H,3-8H2,1-2H3,(H,11,14)
InChIKey
DDAGYTSVNDZBSH-UHFFFAOYSA-N
Compound name
2-(2,2-dimethylthiomorpholin-4-yl)-N-(2-hydroxyethyl)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

232.12454 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 233.13182 152.1
[M+Na]+ 255.11376 156.3
[M-H]- 231.11726 151.9
[M+NH4]+ 250.15836 170.0
[M+K]+ 271.08770 154.1
[M+H-H2O]+ 215.12180 146.3
[M+HCOO]- 277.12274 164.4
[M+CH3COO]- 291.13839 188.2
[M+Na-2H]- 253.09921 153.4
[M]+ 232.12399 150.4
[M]- 232.12509 150.4
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

No patent data available for this compound.