CID 55290311

1-(carbamoylamino)cyclopropane-1-carboxylic acid

Structural Information

Molecular Formula
C5H8N2O3
SMILES
C1CC1(C(=O)O)NC(=O)N
InChI
InChI=1S/C5H8N2O3/c6-4(10)7-5(1-2-5)3(8)9/h1-2H2,(H,8,9)(H3,6,7,10)
InChIKey
VECVSZDWIINWIK-UHFFFAOYSA-N
Compound name
1-(carbamoylamino)cyclopropane-1-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

144.0535 Da
Monoisotopic Mass

-1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 145.06078 126.1
[M+Na]+ 167.04272 134.5
[M-H]- 143.04622 129.5
[M+NH4]+ 162.08732 142.9
[M+K]+ 183.01666 133.0
[M+H-H2O]+ 127.05076 122.0
[M+HCOO]- 189.05170 149.2
[M+CH3COO]- 203.06735 177.7
[M+Na-2H]- 165.02817 132.1
[M]+ 144.05295 126.1
[M]- 144.05405 126.1
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.