CID 3037072

Hexahydro-4,7-methano-1h-indenyl acrylate

Structural Information

Molecular Formula
C13H16O2
SMILES
C=CC(=O)OC1C=CC2C1C3CCC2C3
InChI
InChI=1S/C13H16O2/c1-2-12(14)15-11-6-5-10-8-3-4-9(7-8)13(10)11/h2,5-6,8-11,13H,1,3-4,7H2
InChIKey
ISRJTGUYHVPAOR-UHFFFAOYSA-N
Compound name
3-tricyclo[5.2.1.02,6]dec-4-enyl prop-2-enoate
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

3069
Patents

204.11504 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 205.12232 147.5
[M+Na]+ 227.10426 155.1
[M+NH4]+ 222.14886 156.8
[M+K]+ 243.07820 154.6
[M-H]- 203.10776 147.3
[M+Na-2H]- 225.08971 146.8
[M]+ 204.11449 148.1
[M]- 204.11559 148.1
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