CID 3022689

Hexacosyl methacrylate

Structural Information

Molecular Formula
C30H58O2
SMILES
CCCCCCCCCCCCCCCCCCCCCCCCCCOC(=O)C(=C)C
InChI
InChI=1S/C30H58O2/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28-32-30(31)29(2)3/h2,4-28H2,1,3H3
InChIKey
VLASYNJZKUULNK-UHFFFAOYSA-N
Compound name
hexacosyl 2-methylprop-2-enoate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

483
Patents

450.4437 Da
Monoisotopic Mass

14.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 451.450976 231.2
[M+Na]+ 473.432918 228.6
[M-H]- 449.436424 214.3
[M+NH4]+ 468.477523 229.9
[M+K]+ 489.406858 222.8
[M+H-H2O]+ 433.440960 222.4
[M+HCOO]- 495.441901 237.3
[M+CH3COO]- 509.457551 241.6
[M+Na-2H]- 471.418366 223.0
[M]+ 450.44315142 230.8
[M]- 450.44424858 230.8
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