CID 116406131

1600195-98-9

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]+ 233.131816 152.1
[M+Na]+ 255.113758 156.3
[M-H]- 231.117264 151.9
[M+NH4]+ 250.158363 170.0
[M+K]+ 271.087698 154.1
[M+H-H2O]+ 215.121800 146.3
[M+HCOO]- 277.122741 164.4
[M+CH3COO]- 291.138391 188.2
[M+Na-2H]- 253.099206 153.4
[M]+ 232.12399142 150.4
[M]- 232.12508858 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.