CID 2763516

66318-15-8

Structural Information

Molecular Formula
C9H11NO4
SMILES
CCOC(=O)CNC(=O)C1=CC=CO1
InChI
InChI=1S/C9H11NO4/c1-2-13-8(11)6-10-9(12)7-4-3-5-14-7/h3-5H,2,6H2,1H3,(H,10,12)
InChIKey
PPKUFYUCBZLPPP-UHFFFAOYSA-N
Compound name
ethyl 2-(furan-2-carbonylamino)acetate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

7
Patents

197.0688 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 198.076076 142.1
[M+Na]+ 220.058018 148.4
[M-H]- 196.061524 146.3
[M+NH4]+ 215.102623 161.2
[M+K]+ 236.031958 149.3
[M+H-H2O]+ 180.066060 136.0
[M+HCOO]- 242.067001 166.7
[M+CH3COO]- 256.082651 183.0
[M+Na-2H]- 218.043466 146.8
[M]+ 197.06825142 145.3
[M]- 197.06934858 145.3
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