CID 19042

Pentaerythritol triacrylate

Structural Information

Molecular Formula
C14H18O7
SMILES
C=CC(=O)OCC(CO)(COC(=O)C=C)COC(=O)C=C
InChI
InChI=1S/C14H18O7/c1-4-11(16)19-8-14(7-15,9-20-12(17)5-2)10-21-13(18)6-3/h4-6,15H,1-3,7-10H2
InChIKey
HVVWZTWDBSEWIH-UHFFFAOYSA-N
Compound name
[2-(hydroxymethyl)-3-prop-2-enoyloxy-2-(prop-2-enoyloxymethyl)propyl] prop-2-enoate
Related CIDs

2D Structure

compound 2d structure
5
Annotation Hits

64
References

104577
Patents

298.10526 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 299.11254 165.1
[M+Na]+ 321.09448 169.9
[M-H]- 297.09798 163.1
[M+NH4]+ 316.13908 175.0
[M+K]+ 337.06842 168.6
[M+H-H2O]+ 281.10252 159.8
[M+HCOO]- 343.10346 182.8
[M+CH3COO]- 357.11911 198.4
[M+Na-2H]- 319.07993 165.6
[M]+ 298.10471 170.9
[M]- 298.10581 170.9
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

No patent data available for this compound.