CID 386197

99324-91-1

Structural Information

Molecular Formula
C5H9NO2
SMILES
CNC1(CC1)C(=O)O
InChI
InChI=1S/C5H9NO2/c1-6-5(2-3-5)4(7)8/h6H,2-3H2,1H3,(H,7,8)
InChIKey
ZCLBLSZZIRMCLZ-UHFFFAOYSA-N
Compound name
1-(methylamino)cyclopropane-1-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

97
Patents

115.06333 Da
Monoisotopic Mass

-2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 116.07061 124.2
[M+Na]+ 138.05255 134.8
[M+NH4]+ 133.09715 133.8
[M+K]+ 154.02649 130.5
[M-H]- 114.05605 131.6
[M+Na-2H]- 136.03800 132.6
[M]+ 115.06278 128.7
[M]- 115.06388 128.7
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

patents stripe