CID 10220323

St-101

Structural Information

Molecular Formula

C₁₅H₁₂N₂O

SMILES

C1C2=CC=CC=C2CC13C(=O)N=C4N3C=CC=C4

InChI

InChI=1S/C15H12N2O/c18-14-15(17-8-4-3-7-13(17)16-14)9-11-5-1-2-6-12(11)10-15/h1-8H,9-10H2

InChIKey

QZWYXEBIQWJXAR-UHFFFAOYSA-N

Compound name

spiro[1,3-dihydroindene-2,3'-imidazo[1,2-a]pyridine]-2'-one

Related CIDs

2D Structure

compound 2d structure

4
Annotation Hits: 18
References: 175
Patents: 236.09496 Da
Monoisotopic Mass: 1.9
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]+	237.10224	153.4
[M+Na]+	259.08418	164.1
[M-H]-	235.08768	159.1
[M+NH4]+	254.12878	176.4
[M+K]+	275.05812	158.6
[M+H-H2O]+	219.09222	145.5
[M+HCOO]-	281.09316	173.6
[M+CH3COO]-	295.10881	166.5
[M+Na-2H]-	257.06963	158.6
[M]+	236.09441	152.7
[M]-	236.09551	152.7

Literature stripe

literature stripe

Patent stripe

patents stripe