CID 12453027

Rac-(2r,3r)-2,3-dimethylcyclopropane-1-carboxylic acid

Structural Information

Molecular Formula
C6H10O2
SMILES
C[C@@H]1[C@H](C1C(=O)O)C
InChI
InChI=1S/C6H10O2/c1-3-4(2)5(3)6(7)8/h3-5H,1-2H3,(H,7,8)/t3-,4-/m1/s1
InChIKey
VEQMUQZKBLIXLT-QWWZWVQMSA-N
Compound name
(2R,3R)-2,3-dimethylcyclopropane-1-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

11
Patents

114.06808 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 115.07536 121.9
[M+Na]+ 137.05730 134.0
[M+NH4]+ 132.10190 130.5
[M+K]+ 153.03124 131.2
[M-H]- 113.06080 129.0
[M+Na-2H]- 135.04275 128.6
[M]+ 114.06753 126.5
[M]- 114.06863 126.5
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.