CID 70933

Ethylcyclopropane

Structural Information

Molecular Formula

C₅H₁₀

SMILES

CCC1CC1

InChI

InChI=1S/C5H10/c1-2-5-3-4-5/h5H,2-4H2,1H3

InChIKey

FOTXAJDDGPYIFU-UHFFFAOYSA-N

Compound name

ethylcyclopropane

Related CIDs

2D Structure

compound 2d structure

5
Annotation Hits: 5
References: 25782
Patents: 70.07825 Da
Monoisotopic Mass: 2.4
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]+	71.085526	112.2
[M+Na]+	93.067468	121.8
[M-H]-	69.070974	117.3
[M+NH4]+	88.112073	132.0
[M+K]+	109.04141	121.1
[M+H-H2O]+	53.075510	107.1
[M+HCOO]-	115.07645	136.8
[M+CH3COO]-	129.09210	166.9
[M+Na-2H]-	91.052916	120.7
[M]+	70.077701	114.3
[M]-	70.078799	114.3

Literature stripe

literature stripe

Patent stripe

patents stripe