CID 3036975

Einecs 256-062-6

Structural Information

Molecular Formula
C20H28O4
SMILES
CC(=C)C(=O)OCC1CCC2C1C3CC(C2C3)COC(=O)C(=C)C
InChI
InChI=1S/C20H28O4/c1-11(2)19(21)23-9-13-5-6-16-17-8-14(18(13)16)7-15(17)10-24-20(22)12(3)4/h13-18H,1,3,5-10H2,2,4H3
InChIKey
OIUQBTZLCOMNCC-UHFFFAOYSA-N
Compound name
[8-(2-methylprop-2-enoyloxymethyl)-3-tricyclo[5.2.1.02,6]decanyl]methyl 2-methylprop-2-enoate
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

35
Patents

332.19876 Da
Monoisotopic Mass

4.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 333.20604 182.2
[M+Na]+ 355.18798 185.8
[M+NH4]+ 350.23258 188.2
[M+K]+ 371.16192 187.5
[M-H]- 331.19148 179.5
[M+Na-2H]- 353.17343 176.8
[M]+ 332.19821 181.2
[M]- 332.19931 181.2
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