CID 9860529

154447-35-5

Structural Information

Molecular Formula

C₁₇H₁₅NO₃

SMILES

C1COCCN1C2=CC(=O)C3=C(O2)C4=CC=CC=C4C=C3

InChI

InChI=1S/C17H15NO3/c19-15-11-16(18-7-9-20-10-8-18)21-17-13-4-2-1-3-12(13)5-6-14(15)17/h1-6,11H,7-10H2

InChIKey

KKTZALUTXUZPSN-UHFFFAOYSA-N

Compound name

2-morpholin-4-ylbenzo[h]chromen-4-one

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 84
References: 171
Patents: 281.1052 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]+	282.11248	161.0
[M+Na]+	304.09442	170.2
[M-H]-	280.09792	169.4
[M+NH4]+	299.13902	174.6
[M+K]+	320.06836	167.7
[M+H-H2O]+	264.10246	151.5
[M+HCOO]-	326.10340	178.4
[M+CH3COO]-	340.11905	173.1
[M+Na-2H]-	302.07987	170.3
[M]+	281.10465	161.9
[M]-	281.10575	161.9

Literature stripe

literature stripe

Patent stripe

patents stripe