CID 154856941

2460750-73-4

Structural Information

Molecular Formula
C10H16O3
SMILES
CCC12CCC(CC1)(CO2)C(=O)O
InChI
InChI=1S/C10H16O3/c1-2-10-5-3-9(4-6-10,7-13-10)8(11)12/h2-7H2,1H3,(H,11,12)
InChIKey
CVRYTEIFLNZYJG-UHFFFAOYSA-N
Compound name
1-ethyl-2-oxabicyclo[2.2.2]octane-4-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

184.10994 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 185.11722 141.2
[M+Na]+ 207.09916 149.8
[M+NH4]+ 202.14376 153.8
[M+K]+ 223.07310 140.7
[M-H]- 183.10266 139.5
[M+Na-2H]- 205.08461 140.6
[M]+ 184.10939 142.1
[M]- 184.11049 142.1
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.