CID 86278256

Beheneth-25 methacrylate

Structural Information

Molecular Formula
C28H54O3
SMILES
CCCCCCCCCCCCCCCCCCCCCCOCCOC(=O)C(=C)C
InChI
InChI=1S/C28H54O3/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-30-25-26-31-28(29)27(2)3/h2,4-26H2,1,3H3
InChIKey
KIOWXTOCDZJCBM-UHFFFAOYSA-N
Compound name
2-docosoxyethyl 2-methylprop-2-enoate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2096
Patents

438.4073 Da
Monoisotopic Mass

11.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 439.41458 225.3
[M+Na]+ 461.39652 223.6
[M-H]- 437.40002 210.6
[M+NH4]+ 456.44112 225.6
[M+K]+ 477.37046 218.7
[M+H-H2O]+ 421.40456 216.7
[M+HCOO]- 483.40550 233.0
[M+CH3COO]- 497.42115 237.5
[M+Na-2H]- 459.38197 218.3
[M]+ 438.40675 225.8
[M]- 438.40785 225.8
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe