CID 62556

Pentaerythritol tetraacrylate

Structural Information

Molecular Formula
C17H20O8
SMILES
C=CC(=O)OCC(COC(=O)C=C)(COC(=O)C=C)COC(=O)C=C
InChI
InChI=1S/C17H20O8/c1-5-13(18)22-9-17(10-23-14(19)6-2,11-24-15(20)7-3)12-25-16(21)8-4/h5-8H,1-4,9-12H2
InChIKey
KNSXNCFKSZZHEA-UHFFFAOYSA-N
Compound name
[3-prop-2-enoyloxy-2,2-bis(prop-2-enoyloxymethyl)propyl] prop-2-enoate
Related CIDs

2D Structure

compound 2d structure
5
Annotation Hits

10
References

36612
Patents

352.1158 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 353.12308 180.4
[M+Na]+ 375.10502 191.4
[M-H]- 351.10852 184.4
[M+NH4]+ 370.14962 192.7
[M+K]+ 391.07896 184.5
[M+H-H2O]+ 335.11306 170.0
[M+HCOO]- 397.11400 194.9
[M+CH3COO]- 411.12965 210.3
[M+Na-2H]- 373.09047 174.7
[M]+ 352.11525 183.9
[M]- 352.11635 183.9
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe