CID 58718570

2-[1-(2-methoxy-2-oxoethyl)cyclopentyl]acetic acid

Structural Information

Molecular Formula
C10H16O4
SMILES
COC(=O)CC1(CCCC1)CC(=O)O
InChI
InChI=1S/C10H16O4/c1-14-9(13)7-10(6-8(11)12)4-2-3-5-10/h2-7H2,1H3,(H,11,12)
InChIKey
WMRCVFGWAKNFMD-UHFFFAOYSA-N
Compound name
2-[1-(2-methoxy-2-oxoethyl)cyclopentyl]acetic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

11
Patents

200.10486 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 201.11214 146.5
[M+Na]+ 223.09408 153.4
[M+NH4]+ 218.13868 154.1
[M+K]+ 239.06802 149.9
[M-H]- 199.09758 144.9
[M+Na-2H]- 221.07953 149.4
[M]+ 200.10431 146.6
[M]- 200.10541 146.6
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

patents stripe