CID 56807259

2-(propan-2-yl)thiomorpholine

Structural Information

Molecular Formula
C7H15NS
SMILES
CC(C)C1CNCCS1
InChI
InChI=1S/C7H15NS/c1-6(2)7-5-8-3-4-9-7/h6-8H,3-5H2,1-2H3
InChIKey
PZXQCEVMESPTFU-UHFFFAOYSA-N
Compound name
2-propan-2-ylthiomorpholine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

18
Patents

145.09251 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 146.09979 131.2
[M+Na]+ 168.08173 141.1
[M+NH4]+ 163.12633 140.6
[M+K]+ 184.05567 133.4
[M-H]- 144.08523 132.8
[M+Na-2H]- 166.06718 135.4
[M]+ 145.09196 133.3
[M]- 145.09306 133.3
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

No patent data available for this compound.