CID 105430849

3-cyclobutylthiomorpholine hydrochloride

Structural Information

Molecular Formula
C8H15NS
SMILES
C1CC(C1)C2CSCCN2
InChI
InChI=1S/C8H15NS/c1-2-7(3-1)8-6-10-5-4-9-8/h7-9H,1-6H2
InChIKey
HSGUAKRNPCWPOZ-UHFFFAOYSA-N
Compound name
3-cyclobutylthiomorpholine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

157.09251 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 158.09979 126.5
[M+Na]+ 180.08173 129.2
[M-H]- 156.08523 129.0
[M+NH4]+ 175.12633 139.0
[M+K]+ 196.05567 129.8
[M+H-H2O]+ 140.08977 114.6
[M+HCOO]- 202.09071 137.6
[M+CH3COO]- 216.10636 175.2
[M+Na-2H]- 178.06718 128.5
[M]+ 157.09196 128.5
[M]- 157.09306 128.5
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.