CID 14789039

132435-30-4

Structural Information

Molecular Formula
C10H14O3
SMILES
C1CC2CC3(C1CC2=O)OCCO3
InChI
InChI=1S/C10H14O3/c11-9-5-8-2-1-7(9)6-10(8)12-3-4-13-10/h7-8H,1-6H2
InChIKey
PAEHPXBPMYLKFT-UHFFFAOYSA-N
Compound name
spiro[1,3-dioxolane-2,5'-bicyclo[2.2.2]octane]-2'-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

38
Patents

182.0943 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 183.10158 134.9
[M+Na]+ 205.08352 144.4
[M+NH4]+ 200.12812 147.3
[M+K]+ 221.05746 138.8
[M-H]- 181.08702 136.6
[M+Na-2H]- 203.06897 133.5
[M]+ 182.09375 136.8
[M]- 182.09485 136.8
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe