CID 1498163

31101-37-8

Structural Information

Molecular Formula
C8H12N2OS
SMILES
C1CCN(CC1)C2=NC(=O)CS2
InChI
InChI=1S/C8H12N2OS/c11-7-6-12-8(9-7)10-4-2-1-3-5-10/h1-6H2
InChIKey
CLFGVFOSEHLIBT-UHFFFAOYSA-N
Compound name
2-piperidin-1-yl-1,3-thiazol-4-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

11
Patents

184.06703 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 185.07431 139.9
[M+Na]+ 207.05625 150.4
[M+NH4]+ 202.10085 148.9
[M+K]+ 223.03019 144.1
[M-H]- 183.05975 142.3
[M+Na-2H]- 205.04170 145.0
[M]+ 184.06648 142.3
[M]- 184.06758 142.3
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe