CID 3041075

4,4-dimethyl-2-methoxymethyl-2-oxazoline

Structural Information

Molecular Formula

C₇H₁₃NO₂

SMILES

CC1(COC(=N1)COC)C

InChI

InChI=1S/C7H13NO2/c1-7(2)5-10-6(8-7)4-9-3/h4-5H2,1-3H3

InChIKey

ONMRSDGRLVKJMN-UHFFFAOYSA-N

Compound name

2-(methoxymethyl)-4,4-dimethyl-5H-1,3-oxazole

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 3
Patents: 143.09464 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]+	144.10192	128.4
[M+Na]+	166.08386	139.6
[M+NH4]+	161.12846	138.0
[M+K]+	182.05780	134.6
[M-H]-	142.08736	130.3
[M+Na-2H]-	164.06931	134.5
[M]+	143.09409	130.6
[M]-	143.09519	130.6

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe