CID 135429981

36820-81-2

Structural Information

Molecular Formula

C₁₁H₉N₃O₂

SMILES

COC1=CC2=C(C=C1)NC3=C2C=NNC3=O

InChI

InChI=1S/C11H9N3O2/c1-16-6-2-3-9-7(4-6)8-5-12-14-11(15)10(8)13-9/h2-5,13H,1H3,(H,14,15)

InChIKey

JJFRRONWXDVIDD-UHFFFAOYSA-N

Compound name

8-methoxy-3,5-dihydropyridazino[4,5-b]indol-4-one

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 2
References: 0
Patents: 215.06947 Da
Monoisotopic Mass: 1.1
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]+	216.07675	144.5
[M+Na]+	238.05869	159.4
[M+NH4]+	233.10329	152.1
[M+K]+	254.03263	154.7
[M-H]-	214.06219	144.9
[M+Na-2H]-	236.04414	150.2
[M]+	215.06892	146.6
[M]-	215.07002	146.6

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.