CID 3035278

2-norbornanecarboxylic acid, 5,6-epoxy-, ethyl ester

Structural Information

Molecular Formula
C10H14O3
SMILES
CCOC(=O)C1CC2CC1C3C2O3
InChI
InChI=1S/C10H14O3/c1-2-12-10(11)7-4-5-3-6(7)9-8(5)13-9/h5-9H,2-4H2,1H3
InChIKey
DKVJAOMZYNDXCB-UHFFFAOYSA-N
Compound name
ethyl 3-oxatricyclo[3.2.1.02,4]octane-6-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

182.0943 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 183.10158 139.9
[M+Na]+ 205.08352 150.2
[M-H]- 181.08702 145.3
[M+NH4]+ 200.12812 159.9
[M+K]+ 221.05746 148.0
[M+H-H2O]+ 165.09156 136.3
[M+HCOO]- 227.09250 158.5
[M+CH3COO]- 241.10815 185.7
[M+Na-2H]- 203.06897 144.1
[M]+ 182.09375 146.0
[M]- 182.09485 146.0
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