CID 6483922

4-(1-methyl-1h-imidazol-2-yl)piperidin-4-ol dihydrochloride

Structural Information

Molecular Formula
C9H15N3O
SMILES
CN1C=CN=C1C2(CCNCC2)O
InChI
InChI=1S/C9H15N3O/c1-12-7-6-11-8(12)9(13)2-4-10-5-3-9/h6-7,10,13H,2-5H2,1H3
InChIKey
KDHIXBKIBCKZQU-UHFFFAOYSA-N
Compound name
4-(1-methylimidazol-2-yl)piperidin-4-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

28
Patents

181.1215 Da
Monoisotopic Mass

-0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 182.128776 141.2
[M+Na]+ 204.110718 147.8
[M-H]- 180.114224 140.9
[M+NH4]+ 199.155323 159.2
[M+K]+ 220.084658 144.6
[M+H-H2O]+ 164.118760 133.3
[M+HCOO]- 226.119701 157.0
[M+CH3COO]- 240.135351 152.1
[M+Na-2H]- 202.096166 145.5
[M]+ 181.12095142 134.9
[M]- 181.12204858 134.9
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