CID 214398

33156-84-2

Structural Information

Molecular Formula

C₁₇H₁₆N₂O₂

SMILES

COC1=CC=C(C=C1)C2(C3=CC=CC=C3C4=NCCN42)O

InChI

InChI=1S/C17H16N2O2/c1-21-13-8-6-12(7-9-13)17(20)15-5-3-2-4-14(15)16-18-10-11-19(16)17/h2-9,20H,10-11H2,1H3

InChIKey

HQICEQOCYAITRP-UHFFFAOYSA-N

Compound name

5-(4-methoxyphenyl)-2,3-dihydroimidazo[1,2-b]isoindol-5-ol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 7
Patents: 280.1212 Da
Monoisotopic Mass: 1.5
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]+	281.12848	164.3
[M+Na]+	303.11042	177.9
[M+NH4]+	298.15502	174.7
[M+K]+	319.08436	172.2
[M-H]-	279.11392	167.7
[M+Na-2H]-	301.09587	171.7
[M]+	280.12065	167.4
[M]-	280.12175	167.4

Literature stripe

literature stripe

Patent stripe

patents stripe