CID 54592591

2-methyl-1-(4-methyl-1,3-thiazol-2-yl)piperazine

Structural Information

Molecular Formula
C9H15N3S
SMILES
CC1CNCCN1C2=NC(=CS2)C
InChI
InChI=1S/C9H15N3S/c1-7-6-13-9(11-7)12-4-3-10-5-8(12)2/h6,8,10H,3-5H2,1-2H3
InChIKey
SJSZICVCNDZNFE-UHFFFAOYSA-N
Compound name
4-methyl-2-(2-methylpiperazin-1-yl)-1,3-thiazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

197.09866 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 198.105936 143.5
[M+Na]+ 220.087878 151.5
[M-H]- 196.091384 144.9
[M+NH4]+ 215.132483 160.9
[M+K]+ 236.061818 147.7
[M+H-H2O]+ 180.095920 136.0
[M+HCOO]- 242.096861 155.7
[M+CH3COO]- 256.112511 154.9
[M+Na-2H]- 218.073326 143.1
[M]+ 197.09811142 140.3
[M]- 197.09920858 140.3
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.