CID 57468215

2-cyclopropyl-2-hydroxypropanoic acid

Structural Information

Molecular Formula
C6H10O3
SMILES
CC(C1CC1)(C(=O)O)O
InChI
InChI=1S/C6H10O3/c1-6(9,5(7)8)4-2-3-4/h4,9H,2-3H2,1H3,(H,7,8)
InChIKey
RSLBTTSLQYKDLV-UHFFFAOYSA-N
Compound name
2-cyclopropyl-2-hydroxypropanoic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

14
Patents

130.06299 Da
Monoisotopic Mass

0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 131.070266 124.3
[M+Na]+ 153.052208 133.1
[M-H]- 129.055714 126.7
[M+NH4]+ 148.096813 140.2
[M+K]+ 169.026148 131.1
[M+H-H2O]+ 113.060250 119.9
[M+HCOO]- 175.061191 143.9
[M+CH3COO]- 189.076841 170.4
[M+Na-2H]- 151.037656 130.6
[M]+ 130.06244142 125.8
[M]- 130.06353858 125.8
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