CID 29854

2-methylglycidyl acrylate

Structural Information

Molecular Formula

C₇H₁₀O₃

SMILES

CC1(CO1)COC(=O)C=C

InChI

InChI=1S/C7H10O3/c1-3-6(8)9-4-7(2)5-10-7/h3H,1,4-5H2,2H3

InChIKey

ARYIITVULFDIQB-UHFFFAOYSA-N

Compound name

(2-methyloxiran-2-yl)methyl prop-2-enoate

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 1217
Patents: 142.06299 Da
Monoisotopic Mass: 0.6
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]+	143.07027	129.8
[M+Na]+	165.05221	139.7
[M-H]-	141.05571	135.7
[M+NH4]+	160.09681	147.3
[M+K]+	181.02615	140.4
[M+H-H2O]+	125.06025	125.2
[M+HCOO]-	187.06119	152.3
[M+CH3COO]-	201.07684	176.1
[M+Na-2H]-	163.03766	137.9
[M]+	142.06244	136.0
[M]-	142.06354	136.0

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe