CID 43444910

[(cyclopropylmethyl)carbamoyl]formic acid

Structural Information

Molecular Formula
C6H9NO3
SMILES
C1CC1CNC(=O)C(=O)O
InChI
InChI=1S/C6H9NO3/c8-5(6(9)10)7-3-4-1-2-4/h4H,1-3H2,(H,7,8)(H,9,10)
InChIKey
BUSXSAFJXYHUFF-UHFFFAOYSA-N
Compound name
2-(cyclopropylmethylamino)-2-oxoacetic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

6
Patents

143.05824 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 144.06552 130.0
[M+Na]+ 166.04746 139.5
[M+NH4]+ 161.09206 137.2
[M+K]+ 182.02140 137.8
[M-H]- 142.05096 136.3
[M+Na-2H]- 164.03291 135.7
[M]+ 143.05769 133.7
[M]- 143.05879 133.7
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