CID 91654519

Rac-methyl (1r,2r)-2-(pyridin-2-yl)cyclopropane-1-carboxylate

Structural Information

Molecular Formula
C10H11NO2
SMILES
COC(=O)[C@@H]1C[C@H]1C2=CC=CC=N2
InChI
InChI=1S/C10H11NO2/c1-13-10(12)8-6-7(8)9-4-2-3-5-11-9/h2-5,7-8H,6H2,1H3/t7-,8-/m1/s1
InChIKey
ZLGLOWZDHZRZIJ-HTQZYQBOSA-N
Compound name
methyl (1R,2R)-2-pyridin-2-ylcyclopropane-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

177.07898 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 178.08626 139.4
[M+Na]+ 200.06820 149.3
[M-H]- 176.07170 145.9
[M+NH4]+ 195.11280 153.5
[M+K]+ 216.04214 146.7
[M+H-H2O]+ 160.07624 132.1
[M+HCOO]- 222.07718 162.6
[M+CH3COO]- 236.09283 183.3
[M+Na-2H]- 198.05365 145.4
[M]+ 177.07843 143.0
[M]- 177.07953 143.0
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.