CID 23174

Dicyclobutylidene

Structural Information

Molecular Formula

C₈H₁₂

SMILES

C1CC(=C2CCC2)C1

InChI

InChI=1S/C8H12/c1-3-7(4-1)8-5-2-6-8/h1-6H2

InChIKey

ANQVAFUCYRTKOQ-UHFFFAOYSA-N

Compound name

cyclobutylidenecyclobutane

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 2
References: 86
Patents: 108.0939 Da
Monoisotopic Mass: 1.9
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]+	109.10118	124.6
[M+Na]+	131.08312	126.8
[M+NH4]+	126.12772	126.5
[M+K]+	147.05706	124.5
[M-H]-	107.08662	122.7
[M+Na-2H]-	129.06857	126.4
[M]+	108.09335	122.1
[M]-	108.09445	122.1

Literature stripe

literature stripe

Patent stripe

patents stripe