CID 9250

Cyclobutane

Structural Information

Molecular Formula

C₄H₈

SMILES

C1CCC1

InChI

InChI=1S/C4H8/c1-2-4-3-1/h1-4H2

InChIKey

PMPVIKIVABFJJI-UHFFFAOYSA-N

Compound name

cyclobutane

Related CIDs

2D Structure

compound 2d structure

4
Annotation Hits: 406
References: 80325
Patents: 56.0626 Da
Monoisotopic Mass: 2.5
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]+	57.069876	105.3
[M+Na]+	79.051818	112.5
[M+NH4]+	74.096423	111.7
[M+K]+	95.025758	108.5
[M-H]-	55.055324	105.0
[M+Na-2H]-	77.037266	110.2
[M]+	56.062051	105.0
[M]-	56.063149	105.0

Literature stripe

literature stripe

Patent stripe

patents stripe