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]+ 198.10594 143.5
[M+Na]+ 220.08788 151.5
[M-H]- 196.09138 144.9
[M+NH4]+ 215.13248 160.9
[M+K]+ 236.06182 147.7
[M+H-H2O]+ 180.09592 136.0
[M+HCOO]- 242.09686 155.7
[M+CH3COO]- 256.11251 154.9
[M+Na-2H]- 218.07333 143.1
[M]+ 197.09811 140.3
[M]- 197.09921 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.