CID 13847825

Isoicosyl methacrylate

Structural Information

Molecular Formula

C₂₄H₄₆O₂

SMILES

CC(C)CCCCCCCCCCCCCCCCCOC(=O)C(=C)C

InChI

InChI=1S/C24H46O2/c1-22(2)20-18-16-14-12-10-8-6-5-7-9-11-13-15-17-19-21-26-24(25)23(3)4/h22H,3,5-21H2,1-2,4H3

InChIKey

DCJOCPLKOTVHGV-UHFFFAOYSA-N

Compound name

18-methylnonadecyl 2-methylprop-2-enoate

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 9
Patents: 366.3498 Da
Monoisotopic Mass: 11.3
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]+	367.357076	205.5
[M+Na]+	389.339018	205.3
[M-H]-	365.342524	202.7
[M+NH4]+	384.383623	218.1
[M+K]+	405.312958	201.5
[M+H-H2O]+	349.347060	198.0
[M+HCOO]-	411.348001	221.3
[M+CH3COO]-	425.363651	224.9
[M+Na-2H]-	387.324466	199.3
[M]+	366.34925142	213.1
[M]-	366.35034858	213.1

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe