CID 3036974

Octahydro-1h-4,7-methanoindene-1,5-diyldimethanediyl bisprop-2-enoate

Structural Information

Molecular Formula
C18H24O4
SMILES
C=CC(=O)OCC1CCC2C1C3CC(C2C3)COC(=O)C=C
InChI
InChI=1S/C18H24O4/c1-3-16(19)21-9-11-5-6-14-15-8-12(18(11)14)7-13(15)10-22-17(20)4-2/h3-4,11-15,18H,1-2,5-10H2
InChIKey
VEBCLRKUSAGCDF-UHFFFAOYSA-N
Compound name
[8-(prop-2-enoyloxymethyl)-3-tricyclo[5.2.1.02,6]decanyl]methyl prop-2-enoate
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

17107
Patents

304.16745 Da
Monoisotopic Mass

3.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 305.17473 174.9
[M+Na]+ 327.15667 179.6
[M+NH4]+ 322.20127 181.5
[M+K]+ 343.13061 180.1
[M-H]- 303.16017 172.7
[M+Na-2H]- 325.14212 170.6
[M]+ 304.16690 174.3
[M]- 304.16800 174.3
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