CID 86775501

Ethyl 5-amino-1-(piperidin-4-yl)-1h-imidazole-4-carboxylate

Structural Information

Molecular Formula
C11H18N4O2
SMILES
CCOC(=O)C1=C(N(C=N1)C2CCNCC2)N
InChI
InChI=1S/C11H18N4O2/c1-2-17-11(16)9-10(12)15(7-14-9)8-3-5-13-6-4-8/h7-8,13H,2-6,12H2,1H3
InChIKey
KGFUXFGEVRMONM-UHFFFAOYSA-N
Compound name
ethyl 5-amino-1-piperidin-4-ylimidazole-4-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

238.14297 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 239.15025 155.7
[M+Na]+ 261.13219 160.9
[M-H]- 237.13569 156.2
[M+NH4]+ 256.17679 169.6
[M+K]+ 277.10613 157.9
[M+H-H2O]+ 221.14023 146.7
[M+HCOO]- 283.14117 172.1
[M+CH3COO]- 297.15682 189.8
[M+Na-2H]- 259.11764 156.1
[M]+ 238.14242 150.4
[M]- 238.14352 150.4
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

No patent data available for this compound.