CID 39667

2h-indol-2-one, 1,3-dihydro-3-ethoxy-1-(3-morpholinopropyl)-3-phenyl-, maleate

Structural Information

Molecular Formula

C₂₃H₂₈N₂O₃

SMILES

CCOC1(C2=CC=CC=C2N(C1=O)CCCN3CCOCC3)C4=CC=CC=C4

InChI

InChI=1S/C23H28N2O3/c1-2-28-23(19-9-4-3-5-10-19)20-11-6-7-12-21(20)25(22(23)26)14-8-13-24-15-17-27-18-16-24/h3-7,9-12H,2,8,13-18H2,1H3

InChIKey

FRUVZGHUBRHMOX-UHFFFAOYSA-N

Compound name

3-ethoxy-1-(3-morpholin-4-ylpropyl)-3-phenylindol-2-one

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 380.21 Da
Monoisotopic Mass: 2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	381.217276	193.8
[M+Na]+	403.199218	198.7
[M-H]-	379.202724	200.9
[M+NH4]+	398.243823	205.4
[M+K]+	419.173158	194.5
[M+H-H2O]+	363.207260	182.6
[M+HCOO]-	425.208201	208.2
[M+CH3COO]-	439.223851	202.2
[M+Na-2H]-	401.184666	194.6
[M]+	380.20945142	193.4
[M]-	380.21054858	193.4

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.