CID 24209556

Ethyl 6-oxospiro[2.4]heptane-5-carboxylate

Structural Information

Molecular Formula
C10H14O3
SMILES
CCOC(=O)C1CC2(CC2)CC1=O
InChI
InChI=1S/C10H14O3/c1-2-13-9(12)7-5-10(3-4-10)6-8(7)11/h7H,2-6H2,1H3
InChIKey
BRBZXNIHZZHZMW-UHFFFAOYSA-N
Compound name
ethyl 6-oxospiro[2.4]heptane-5-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

182.0943 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 183.10158 143.3
[M+Na]+ 205.08352 154.0
[M+NH4]+ 200.12812 153.1
[M+K]+ 221.05746 150.3
[M-H]- 181.08702 151.2
[M+Na-2H]- 203.06897 150.4
[M]+ 182.09375 148.1
[M]- 182.09485 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

No patent data available for this compound.