CID 3278078

Ethyl n-z-oxamidate

Structural Information

Molecular Formula
C12H13NO5
SMILES
CCOC(=O)C(=O)NC(=O)OCC1=CC=CC=C1
InChI
InChI=1S/C12H13NO5/c1-2-17-11(15)10(14)13-12(16)18-8-9-6-4-3-5-7-9/h3-7H,2,8H2,1H3,(H,13,14,16)
InChIKey
JREYAXFCOGQLSQ-UHFFFAOYSA-N
Compound name
ethyl 2-oxo-2-(phenylmethoxycarbonylamino)acetate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

251.07938 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 252.08666 155.5
[M+Na]+ 274.06860 164.3
[M+NH4]+ 269.11320 160.6
[M+K]+ 290.04254 160.8
[M-H]- 250.07210 155.0
[M+Na-2H]- 272.05405 159.4
[M]+ 251.07883 156.1
[M]- 251.07993 156.1
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.