CID 21827

Ethoxycyclopropane

Structural Information

Molecular Formula

C₅H₁₀O

SMILES

CCOC1CC1

InChI

InChI=1S/C5H10O/c1-2-6-5-3-4-5/h5H,2-4H2,1H3

InChIKey

LZTCEQQSARXBHE-UHFFFAOYSA-N

Compound name

ethoxycyclopropane

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 1397
Patents: 86.073166 Da
Monoisotopic Mass: 1.0
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]+	87.080442	116.3
[M+Na]+	109.062384	125.9
[M-H]-	85.065890	121.3
[M+NH4]+	104.106989	135.4
[M+K]+	125.036324	125.4
[M+H-H2O]+	69.070426	110.9
[M+HCOO]-	131.071367	141.0
[M+CH3COO]-	145.087017	168.7
[M+Na-2H]-	107.047832	124.5
[M]+	86.07261742	119.7
[M]-	86.07371458	119.7

Literature stripe

literature stripe

Patent stripe

patents stripe