CID 82467807

1-cyclopropyl-1h-imidazole-4-carboxylic acid hydrochloride

Structural Information

Molecular Formula

C₇H₈N₂O₂

SMILES

C1CC1N2C=C(N=C2)C(=O)O

InChI

InChI=1S/C7H8N2O2/c10-7(11)6-3-9(4-8-6)5-1-2-5/h3-5H,1-2H2,(H,10,11)

InChIKey

QAIVKRZQVRDEPE-UHFFFAOYSA-N

Compound name

1-cyclopropylimidazole-4-carboxylic acid

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 40
Patents: 152.05858 Da
Monoisotopic Mass: 0.3
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]+	153.06586	134.3
[M+Na]+	175.04780	146.4
[M+NH4]+	170.09240	142.0
[M+K]+	191.02174	145.0
[M-H]-	151.05130	141.5
[M+Na-2H]-	173.03325	142.0
[M]+	152.05803	138.8
[M]-	152.05913	138.8

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe