CID 115013995

2-[1-(methoxymethyl)cyclopentyl]acetic acid

Structural Information

Molecular Formula
C9H16O3
SMILES
COCC1(CCCC1)CC(=O)O
InChI
InChI=1S/C9H16O3/c1-12-7-9(6-8(10)11)4-2-3-5-9/h2-7H2,1H3,(H,10,11)
InChIKey
WBNZBYZFMAJAQS-UHFFFAOYSA-N
Compound name
2-[1-(methoxymethyl)cyclopentyl]acetic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

172.10994 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 173.11722 139.7
[M+Na]+ 195.09916 147.6
[M+NH4]+ 190.14376 148.4
[M+K]+ 211.07310 143.0
[M-H]- 171.10266 139.2
[M+Na-2H]- 193.08461 143.7
[M]+ 172.10939 140.4
[M]- 172.11049 140.4
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.