CID 50989025

1-(methylcarbamoyl)cyclopropane-1-carboxylic acid

Structural Information

Molecular Formula
C6H9NO3
SMILES
CNC(=O)C1(CC1)C(=O)O
InChI
InChI=1S/C6H9NO3/c1-7-4(8)6(2-3-6)5(9)10/h2-3H2,1H3,(H,7,8)(H,9,10)
InChIKey
ZHKJJVGESBQQBR-UHFFFAOYSA-N
Compound name
1-(methylcarbamoyl)cyclopropane-1-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

9
Patents

143.05824 Da
Monoisotopic Mass

-0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 144.06552 131.5
[M+Na]+ 166.04746 141.2
[M+NH4]+ 161.09206 140.1
[M+K]+ 182.02140 137.9
[M-H]- 142.05096 138.0
[M+Na-2H]- 164.03291 138.8
[M]+ 143.05769 135.6
[M]- 143.05879 135.6
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