CID 106017

2,2-dimethylpentyl methacrylate

Structural Information

Molecular Formula

C₁₁H₂₀O₂

SMILES

CCCC(C)(C)COC(=O)C(=C)C

InChI

InChI=1S/C11H20O2/c1-6-7-11(4,5)8-13-10(12)9(2)3/h2,6-8H2,1,3-5H3

InChIKey

YFDAAPDBSTZCJE-UHFFFAOYSA-N

Compound name

2,2-dimethylpentyl 2-methylprop-2-enoate

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 25
Patents: 184.14633 Da
Monoisotopic Mass: 3.7
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]+	185.15361	145.1
[M+Na]+	207.13555	153.9
[M+NH4]+	202.18015	151.6
[M+K]+	223.10949	149.5
[M-H]-	183.13905	143.0
[M+Na-2H]-	205.12100	147.0
[M]+	184.14578	145.5
[M]-	184.14688	145.5

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe