CID 10856446

Ethyl 6-methyl-1-oxaspiro[2.5]octane-2-carboxylate

Structural Information

Molecular Formula
C11H18O3
SMILES
CCOC(=O)C1C2(O1)CCC(CC2)C
InChI
InChI=1S/C11H18O3/c1-3-13-10(12)9-11(14-9)6-4-8(2)5-7-11/h8-9H,3-7H2,1-2H3
InChIKey
KAJXXKIXJKJMEG-UHFFFAOYSA-N
Compound name
ethyl 6-methyl-1-oxaspiro[2.5]octane-2-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

198.1256 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 199.13288 146.4
[M+Na]+ 221.11482 158.3
[M+NH4]+ 216.15942 156.6
[M+K]+ 237.08876 152.9
[M-H]- 197.11832 156.6
[M+Na-2H]- 219.10027 154.1
[M]+ 198.12505 152.2
[M]- 198.12615 152.2
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

No patent data available for this compound.