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]+ 281.12848 164.4
[M+Na]+ 303.11042 172.0
[M-H]- 279.11392 170.9
[M+NH4]+ 298.15502 181.4
[M+K]+ 319.08436 167.3
[M+H-H2O]+ 263.11846 156.3
[M+HCOO]- 325.11940 186.4
[M+CH3COO]- 339.13505 202.5
[M+Na-2H]- 301.09587 167.5
[M]+ 280.12065 164.3
[M]- 280.12175 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.