CID 44249711

1068160-23-5

Structural Information

Molecular Formula

C₆H₁₀O₂

SMILES

COCC1CC(=O)C1

InChI

InChI=1S/C6H10O2/c1-8-4-5-2-6(7)3-5/h5H,2-4H2,1H3

InChIKey

HVCHAEYIOCQBQO-UHFFFAOYSA-N

Compound name

3-(methoxymethyl)cyclobutan-1-one

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 10
Patents: 114.06808 Da
Monoisotopic Mass: -0.2
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]+	115.07536	120.6
[M+Na]+	137.05730	127.2
[M+NH4]+	132.10190	125.2
[M+K]+	153.03124	123.9
[M-H]-	113.06080	118.9
[M+Na-2H]-	135.04275	123.3
[M]+	114.06753	119.7
[M]-	114.06863	119.7

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe