CID 55301805

2-(1-hydroxycyclopropyl)acetic acid

Structural Information

Molecular Formula
C5H8O3
SMILES
C1CC1(CC(=O)O)O
InChI
InChI=1S/C5H8O3/c6-4(7)3-5(8)1-2-5/h8H,1-3H2,(H,6,7)
InChIKey
KFZBWDNJUMVKMC-UHFFFAOYSA-N
Compound name
2-(1-hydroxycyclopropyl)acetic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

35
Patents

116.04734 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 117.05462 125.0
[M+Na]+ 139.03656 135.9
[M+NH4]+ 134.08116 134.2
[M+K]+ 155.01050 132.0
[M-H]- 115.04006 131.2
[M+Na-2H]- 137.02201 132.7
[M]+ 116.04679 129.3
[M]- 116.04789 129.3
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