CID 24261806

3-[4-(propan-2-yl)-1,3-thiazol-2-yl]piperidine

Structural Information

Molecular Formula
C11H18N2S
SMILES
CC(C)C1=CSC(=N1)C2CCCNC2
InChI
InChI=1S/C11H18N2S/c1-8(2)10-7-14-11(13-10)9-4-3-5-12-6-9/h7-9,12H,3-6H2,1-2H3
InChIKey
KOJUTHALZHVPGR-UHFFFAOYSA-N
Compound name
2-piperidin-3-yl-4-propan-2-yl-1,3-thiazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

210.11906 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 211.126336 148.1
[M+Na]+ 233.108278 153.9
[M-H]- 209.111784 150.3
[M+NH4]+ 228.152883 165.9
[M+K]+ 249.082218 150.3
[M+H-H2O]+ 193.116320 140.9
[M+HCOO]- 255.117261 159.9
[M+CH3COO]- 269.132911 158.9
[M+Na-2H]- 231.093726 146.6
[M]+ 210.11851142 144.1
[M]- 210.11960858 144.1
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.