CID 73854

Pentaerythritol triallyl ether

Structural Information

Molecular Formula
C14H24O4
SMILES
C=CCOCC(CO)(COCC=C)COCC=C
InChI
InChI=1S/C14H24O4/c1-4-7-16-11-14(10-15,12-17-8-5-2)13-18-9-6-3/h4-6,15H,1-3,7-13H2
InChIKey
FYRWKWGEFZTOQI-UHFFFAOYSA-N
Compound name
3-prop-2-enoxy-2,2-bis(prop-2-enoxymethyl)propan-1-ol
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

1
References

13850
Patents

256.16745 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 257.17473 163.1
[M+Na]+ 279.15667 167.7
[M-H]- 255.16017 160.7
[M+NH4]+ 274.20127 179.3
[M+K]+ 295.13061 165.0
[M+H-H2O]+ 239.16471 157.6
[M+HCOO]- 301.16565 182.7
[M+CH3COO]- 315.18130 194.2
[M+Na-2H]- 277.14212 166.4
[M]+ 256.16690 168.8
[M]- 256.16800 168.8
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

No patent data available for this compound.