CID 562745

N-(1-benzyl-2-oxo-2,3-dihydro-1h-indol-3-yl)acetamide

Structural Information

Molecular Formula
C17H16N2O2
SMILES
CC(=O)NC1C2=CC=CC=C2N(C1=O)CC3=CC=CC=C3
InChI
InChI=1S/C17H16N2O2/c1-12(20)18-16-14-9-5-6-10-15(14)19(17(16)21)11-13-7-3-2-4-8-13/h2-10,16H,11H2,1H3,(H,18,20)
InChIKey
ZXEUGBUFRQITPK-UHFFFAOYSA-N
Compound name
N-(1-benzyl-2-oxo-3H-indol-3-yl)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

16
Patents

280.1212 Da
Monoisotopic Mass

1.9
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

literature stripe

Patent stripe

patents stripe