CID 8882

Cyclopentene

Structural Information

Molecular Formula

C₅H₈

SMILES

C1CC=CC1

InChI

InChI=1S/C5H8/c1-2-4-5-3-1/h1-2H,3-5H2

InChIKey

LPIQUOYDBNQMRZ-UHFFFAOYSA-N

Compound name

cyclopentene

Related CIDs

2D Structure

compound 2d structure

5
Annotation Hits: 11599
References: 129429
Patents: 68.0626 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]+	69.069876	110.6
[M+Na]+	91.051818	117.6
[M-H]-	67.055324	114.0
[M+NH4]+	86.096423	136.5
[M+K]+	107.02576	117.5
[M+H-H2O]+	51.059860	105.9
[M+HCOO]-	113.06080	135.7
[M+CH3COO]-	127.07645	159.0
[M+Na-2H]-	89.037266	118.4
[M]+	68.062051	107.9
[M]-	68.063149	107.9

Literature stripe

literature stripe

Patent stripe

patents stripe