CID 118626781

2138212-77-6

Structural Information

Molecular Formula

C₉H₁₄N₄O

SMILES

C1CNCCC1C2=NC=C(N2)C(=O)N

InChI

InChI=1S/C9H14N4O/c10-8(14)7-5-12-9(13-7)6-1-3-11-4-2-6/h5-6,11H,1-4H2,(H2,10,14)(H,12,13)

InChIKey

RXWDJIGBBSHGCA-UHFFFAOYSA-N

Compound name

2-piperidin-4-yl-1H-imidazole-5-carboxamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 2
Patents: 194.11676 Da
Monoisotopic Mass: -0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	195.12404	144.1
[M+Na]+	217.10598	148.9
[M-H]-	193.10948	143.1
[M+NH4]+	212.15058	158.7
[M+K]+	233.07992	144.9
[M+H-H2O]+	177.11402	135.5
[M+HCOO]-	239.11496	159.5
[M+CH3COO]-	253.13061	178.7
[M+Na-2H]-	215.09143	145.8
[M]+	194.11621	134.6
[M]-	194.11731	134.6

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe