CID 3052682

3-thiomorpholinone, 2,2-diethyl-5,5-dimethyl-

Structural Information

Molecular Formula
C10H19NOS
SMILES
CCC1(C(=S)NC(CO1)(C)C)CC
InChI
InChI=1S/C10H19NOS/c1-5-10(6-2)8(13)11-9(3,4)7-12-10/h5-7H2,1-4H3,(H,11,13)
InChIKey
QPXVNDYYYLFPMP-UHFFFAOYSA-N
Compound name
2,2-diethyl-5,5-dimethylmorpholine-3-thione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

201.11873 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 202.12601 145.8
[M+Na]+ 224.10795 156.3
[M+NH4]+ 219.15255 156.7
[M+K]+ 240.08189 145.1
[M-H]- 200.11145 148.0
[M+Na-2H]- 222.09340 151.7
[M]+ 201.11818 148.7
[M]- 201.11928 148.7
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.