CID 368595

Nsc639691

Structural Information

Molecular Formula
C17H16N2O2
SMILES
CC(=O)NN1C2=CC=CC=C2C(C1=O)CC3=CC=CC=C3
InChI
InChI=1S/C17H16N2O2/c1-12(20)18-19-16-10-6-5-9-14(16)15(17(19)21)11-13-7-3-2-4-8-13/h2-10,15H,11H2,1H3,(H,18,20)
InChIKey
DYWGKGNRXOWDLO-UHFFFAOYSA-N
Compound name
N-(3-benzyl-2-oxo-3H-indol-1-yl)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

280.1212 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 281.128476 164.4
[M+Na]+ 303.110418 172.0
[M-H]- 279.113924 170.9
[M+NH4]+ 298.155023 181.4
[M+K]+ 319.084358 167.3
[M+H-H2O]+ 263.118460 156.3
[M+HCOO]- 325.119401 186.4
[M+CH3COO]- 339.135051 202.5
[M+Na-2H]- 301.095866 167.5
[M]+ 280.12065142 164.3
[M]- 280.12174858 164.3
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

No patent data available for this compound.