CID 23528948

34410-16-7

Structural Information

Molecular Formula

C₅H₁₀O₂

SMILES

CCCOC1CO1

InChI

InChI=1S/C5H10O2/c1-2-3-6-5-4-7-5/h5H,2-4H2,1H3

InChIKey

PESZHMNOBZAHOO-UHFFFAOYSA-N

Compound name

2-propoxyoxirane

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 0
References: 67
Patents: 102.06808 Da
Monoisotopic Mass: 0.8
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]+	103.07536	119.8
[M+Na]+	125.05730	129.5
[M-H]-	101.06080	125.4
[M+NH4]+	120.10190	137.1
[M+K]+	141.03124	130.3
[M+H-H2O]+	85.065340	114.0
[M+HCOO]-	147.06628	143.7
[M+CH3COO]-	161.08193	170.4
[M+Na-2H]-	123.04275	129.0
[M]+	102.06753	125.3
[M]-	102.06863	125.3

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe