CID 73560

1,2-cyclobutanedicarboxamide

Structural Information

Molecular Formula

C₆H₁₀N₂O₂

SMILES

C1CC(C1C(=O)N)C(=O)N

InChI

InChI=1S/C6H10N2O2/c7-5(9)3-1-2-4(3)6(8)10/h3-4H,1-2H2,(H2,7,9)(H2,8,10)

InChIKey

SOGOFVIWBWBJJS-UHFFFAOYSA-N

Compound name

cyclobutane-1,2-dicarboxamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 86
Patents: 142.07423 Da
Monoisotopic Mass: -1.5
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]+	143.081506	133.4
[M+Na]+	165.063448	137.4
[M-H]-	141.066954	135.8
[M+NH4]+	160.108053	146.7
[M+K]+	181.037388	140.3
[M+H-H2O]+	125.071490	121.7
[M+HCOO]-	187.072431	154.5
[M+CH3COO]-	201.088081	182.2
[M+Na-2H]-	163.048896	134.5
[M]+	142.07368142	137.0
[M]-	142.07477858	137.0

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe