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

8
Patents

130.06299 Da
Monoisotopic Mass

0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 131.07027 124.3
[M+Na]+ 153.05221 133.1
[M-H]- 129.05571 126.7
[M+NH4]+ 148.09681 140.2
[M+K]+ 169.02615 131.1
[M+H-H2O]+ 113.06025 119.9
[M+HCOO]- 175.06119 143.9
[M+CH3COO]- 189.07684 170.4
[M+Na-2H]- 151.03766 130.6
[M]+ 130.06244 125.8
[M]- 130.06354 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