CID 41500

N-ethyl-2-(1h-indol-3-yl)-2-oxoacetamide

Structural Information

Molecular Formula
C12H12N2O2
SMILES
CCNC(=O)C(=O)C1=CNC2=CC=CC=C21
InChI
InChI=1S/C12H12N2O2/c1-2-13-12(16)11(15)9-7-14-10-6-4-3-5-8(9)10/h3-7,14H,2H2,1H3,(H,13,16)
InChIKey
WHDXKEGUQIBSNS-UHFFFAOYSA-N
Compound name
N-ethyl-2-(1H-indol-3-yl)-2-oxoacetamide
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

3
Patents

216.08987 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 217.097146 146.6
[M+Na]+ 239.079088 154.6
[M-H]- 215.082594 149.0
[M+NH4]+ 234.123693 165.6
[M+K]+ 255.053028 151.0
[M+H-H2O]+ 199.087130 140.0
[M+HCOO]- 261.088071 169.3
[M+CH3COO]- 275.103721 187.0
[M+Na-2H]- 237.064536 151.7
[M]+ 216.08932142 147.0
[M]- 216.09041858 147.0
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