CID 12627052

(1-chloroethyl)cyclopropane

Structural Information

Molecular Formula

SMILES

CC(C1CC1)Cl

InChI

InChI=1S/C5H9Cl/c1-4(6)5-2-3-5/h4-5H,2-3H2,1H3

InChIKey

OLLKVCSBIYCEAV-UHFFFAOYSA-N

Compound name

1-chloroethylcyclopropane

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 25
Patents: 104.039276 Da
Monoisotopic Mass: 2.0
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]+	105.04655	116.2
[M+Na]+	127.02849	129.8
[M+NH4]+	122.07310	126.8
[M+K]+	143.00243	125.0
[M-H]-	103.03200	124.8
[M+Na-2H]-	125.01394	125.3
[M]+	104.03873	121.9
[M]-	104.03982	121.9

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe