CID 7117292

N-(1h-indol-3-yloxoacetyl)glycine ethyl ester

Structural Information

Molecular Formula
C14H14N2O4
SMILES
CCOC(=O)CNC(=O)C(=O)C1=CNC2=CC=CC=C21
InChI
InChI=1S/C14H14N2O4/c1-2-20-12(17)8-16-14(19)13(18)10-7-15-11-6-4-3-5-9(10)11/h3-7,15H,2,8H2,1H3,(H,16,19)
InChIKey
DFYSCFGRDTZECI-UHFFFAOYSA-N
Compound name
ethyl 2-[[2-(1H-indol-3-yl)-2-oxoacetyl]amino]acetate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

274.09537 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 275.10265 161.1
[M+Na]+ 297.08459 170.3
[M+NH4]+ 292.12919 166.3
[M+K]+ 313.05853 168.2
[M-H]- 273.08809 160.2
[M+Na-2H]- 295.07004 164.2
[M]+ 274.09482 161.6
[M]- 274.09592 161.6
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.