CID 22026245

2-oxohexahydro-2h-3,5-methanocyclopenta[b]furan-6-yl methacrylate

Structural Information

Molecular Formula
C12H14O4
SMILES
CC(=C)C(=O)OC1C2CC3C1OC(=O)C3C2
InChI
InChI=1S/C12H14O4/c1-5(2)11(13)15-9-6-3-7-8(4-6)12(14)16-10(7)9/h6-10H,1,3-4H2,2H3
InChIKey
JJMQLQLMPJLIPZ-UHFFFAOYSA-N
Compound name
(5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl) 2-methylprop-2-enoate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1982
Patents

222.0892 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 223.09648 151.4
[M+Na]+ 245.07842 158.7
[M-H]- 221.08192 155.3
[M+NH4]+ 240.12302 176.4
[M+K]+ 261.05236 157.9
[M+H-H2O]+ 205.08646 149.5
[M+HCOO]- 267.08740 169.0
[M+CH3COO]- 281.10305 190.7
[M+Na-2H]- 243.06387 150.9
[M]+ 222.08865 154.2
[M]- 222.08975 154.2
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