CID 154729170

2375195-27-8

Structural Information

Molecular Formula
C10H14O5
SMILES
COC(=O)C12CCC(CC1)(OC2)C(=O)O
InChI
InChI=1S/C10H14O5/c1-14-8(13)9-2-4-10(5-3-9,7(11)12)15-6-9/h2-6H2,1H3,(H,11,12)
InChIKey
AEYAQQBSPKVXSU-UHFFFAOYSA-N
Compound name
4-methoxycarbonyl-2-oxabicyclo[2.2.2]octane-1-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

214.08412 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 215.09140 145.7
[M+Na]+ 237.07334 153.0
[M+NH4]+ 232.11794 156.7
[M+K]+ 253.04728 145.7
[M-H]- 213.07684 142.5
[M+Na-2H]- 235.05879 143.9
[M]+ 214.08357 145.8
[M]- 214.08467 145.8
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.