CID 53414995

4-(5-methyl-1h-imidazol-1-yl)piperidine dihydrochloride

Structural Information

Molecular Formula
C9H15N3
SMILES
CC1=CN=CN1C2CCNCC2
InChI
InChI=1S/C9H15N3/c1-8-6-11-7-12(8)9-2-4-10-5-3-9/h6-7,9-10H,2-5H2,1H3
InChIKey
PGWYRRSGBUCCOR-UHFFFAOYSA-N
Compound name
4-(5-methylimidazol-1-yl)piperidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

4
Patents

165.1266 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 166.133876 138.0
[M+Na]+ 188.115818 144.2
[M-H]- 164.119324 138.6
[M+NH4]+ 183.160423 155.3
[M+K]+ 204.089758 141.1
[M+H-H2O]+ 148.123860 129.3
[M+HCOO]- 210.124801 155.0
[M+CH3COO]- 224.140451 149.3
[M+Na-2H]- 186.101266 141.6
[M]+ 165.12605142 131.8
[M]- 165.12714858 131.8
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

patents stripe