CID 76615

3154-51-6

Structural Information

Molecular Formula
C5H9NO3
SMILES
CCOC(=O)CNC=O
InChI
InChI=1S/C5H9NO3/c1-2-9-5(8)3-6-4-7/h4H,2-3H2,1H3,(H,6,7)
InChIKey
GMBCCEOJUWMBPF-UHFFFAOYSA-N
Compound name
ethyl 2-formamidoacetate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

583
Patents

131.05824 Da
Monoisotopic Mass

-0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 132.065516 124.6
[M+Na]+ 154.047458 131.7
[M-H]- 130.050964 125.1
[M+NH4]+ 149.092063 146.2
[M+K]+ 170.021398 132.3
[M+H-H2O]+ 114.055500 119.6
[M+HCOO]- 176.056441 149.9
[M+CH3COO]- 190.072091 173.2
[M+Na-2H]- 152.032906 131.2
[M]+ 131.05769142 126.9
[M]- 131.05878858 126.9
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.