CID 114488

2,2,4-trimethyl-1,3-pentanediol dimethacrylate

Structural Information

Molecular Formula
C16H26O4
SMILES
CC(C)C(C(C)(C)COC(=O)C(=C)C)OC(=O)C(=C)C
InChI
InChI=1S/C16H26O4/c1-10(2)13(20-15(18)12(5)6)16(7,8)9-19-14(17)11(3)4/h10,13H,3,5,9H2,1-2,4,6-8H3
InChIKey
TVGGFVNRRGKACD-UHFFFAOYSA-N
Compound name
[2,2,4-trimethyl-3-(2-methylprop-2-enoyloxy)pentyl] 2-methylprop-2-enoate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

656
Patents

282.1831 Da
Monoisotopic Mass

4.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 283.19038 168.0
[M+Na]+ 305.17232 173.6
[M+NH4]+ 300.21692 171.4
[M+K]+ 321.14626 172.4
[M-H]- 281.17582 163.3
[M+Na-2H]- 303.15777 166.4
[M]+ 282.18255 166.9
[M]- 282.18365 166.9
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