CID 62774675

122760-86-5

Structural Information

Molecular Formula

C₆H₁₂O₂

SMILES

CC1(CO1)CCOC

InChI

InChI=1S/C6H12O2/c1-6(5-8-6)3-4-7-2/h3-5H2,1-2H3

InChIKey

BNLGYKNXUGMKOD-UHFFFAOYSA-N

Compound name

2-(2-methoxyethyl)-2-methyloxirane

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 1
Patents: 116.08373 Da
Monoisotopic Mass: 0.3
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]+	117.09101	124.1
[M+Na]+	139.07295	134.0
[M-H]-	115.07645	130.0
[M+NH4]+	134.11755	142.7
[M+K]+	155.04689	135.5
[M+H-H2O]+	99.080990	119.5
[M+HCOO]-	161.08193	147.3
[M+CH3COO]-	175.09758	172.9
[M+Na-2H]-	137.05840	133.9
[M]+	116.08318	130.4
[M]-	116.08428	130.4

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe