CID 22051805

(octahydro-4,7-methano-1h-indenyl)methyl acrylate

Structural Information

Molecular Formula
C14H20O2
SMILES
C=CC(=O)OCC1CCC2C1C3CCC2C3
InChI
InChI=1S/C14H20O2/c1-2-13(15)16-8-11-5-6-12-9-3-4-10(7-9)14(11)12/h2,9-12,14H,1,3-8H2
InChIKey
PMPNHSZLJPXGCD-UHFFFAOYSA-N
Compound name
3-tricyclo[5.2.1.02,6]decanylmethyl prop-2-enoate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

87
Patents

220.14633 Da
Monoisotopic Mass

3.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 221.15361 158.1
[M+Na]+ 243.13555 163.9
[M-H]- 219.13905 161.3
[M+NH4]+ 238.18015 184.1
[M+K]+ 259.10949 160.8
[M+H-H2O]+ 203.14359 154.5
[M+HCOO]- 265.14453 176.4
[M+CH3COO]- 279.16018 190.0
[M+Na-2H]- 241.12100 156.3
[M]+ 220.14578 157.1
[M]- 220.14688 157.1
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