CID 55302711

2-(cyclopent-1-en-1-yl)-2-hydroxyacetic acid

Structural Information

Molecular Formula
C7H10O3
SMILES
C1CC=C(C1)C(C(=O)O)O
InChI
InChI=1S/C7H10O3/c8-6(7(9)10)5-3-1-2-4-5/h3,6,8H,1-2,4H2,(H,9,10)
InChIKey
KLPVDROLQMPLPP-UHFFFAOYSA-N
Compound name
2-(cyclopenten-1-yl)-2-hydroxyacetic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

142.06299 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 143.070266 129.8
[M+Na]+ 165.052208 135.6
[M-H]- 141.055714 130.5
[M+NH4]+ 160.096813 151.2
[M+K]+ 181.026148 134.7
[M+H-H2O]+ 125.060250 125.0
[M+HCOO]- 187.061191 150.0
[M+CH3COO]- 201.076841 167.4
[M+Na-2H]- 163.037656 132.2
[M]+ 142.06244142 126.6
[M]- 142.06353858 126.6
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

No patent data available for this compound.