CID 62212878

Methyl 2-cyclopropyl-2-hydroxypropanoate

Structural Information

Molecular Formula
C7H12O3
SMILES
CC(C1CC1)(C(=O)OC)O
InChI
InChI=1S/C7H12O3/c1-7(9,5-3-4-5)6(8)10-2/h5,9H,3-4H2,1-2H3
InChIKey
GIQWECZOGNXQGD-UHFFFAOYSA-N
Compound name
methyl 2-cyclopropyl-2-hydroxypropanoate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

144.07864 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 145.08592 132.4
[M+Na]+ 167.06786 142.9
[M+NH4]+ 162.11246 140.1
[M+K]+ 183.04180 141.0
[M-H]- 143.07136 138.3
[M+Na-2H]- 165.05331 138.5
[M]+ 144.07809 136.4
[M]- 144.07919 136.4
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.