CID 137952214

2219379-52-7

Structural Information

Molecular Formula
C9H13NO2
SMILES
C1CC1N2CC3CC2(C3)C(=O)O
InChI
InChI=1S/C9H13NO2/c11-8(12)9-3-6(4-9)5-10(9)7-1-2-7/h6-7H,1-5H2,(H,11,12)
InChIKey
YVMOSYUCVQRPFX-UHFFFAOYSA-N
Compound name
2-cyclopropyl-2-azabicyclo[2.1.1]hexane-1-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

167.09464 Da
Monoisotopic Mass

-1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 168.10192 141.5
[M+Na]+ 190.08386 149.4
[M-H]- 166.08736 144.0
[M+NH4]+ 185.12846 157.6
[M+K]+ 206.05780 148.5
[M+H-H2O]+ 150.09190 134.3
[M+HCOO]- 212.09284 155.7
[M+CH3COO]- 226.10849 153.1
[M+Na-2H]- 188.06931 147.0
[M]+ 167.09409 154.7
[M]- 167.09519 154.7
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.