CID 5491296

4h-pyridazino(4,5-b)indol-4-one, 3,5-dihydro-8-methoxy-, hydrazone

Structural Information

Molecular Formula

C₁₁H₁₁N₅O

SMILES

COC1=CC2=C(C=C1)NC3=C(N=NC=C23)NN

InChI

InChI=1S/C11H11N5O/c1-17-6-2-3-9-7(4-6)8-5-13-16-11(15-12)10(8)14-9/h2-5,14H,12H2,1H3,(H,15,16)

InChIKey

OCNXTWIJSHIJGF-UHFFFAOYSA-N

Compound name

(8-methoxy-5H-pyridazino[4,5-b]indol-4-yl)hydrazine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 0
Patents: 229.09636 Da
Monoisotopic Mass: 0.9
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]+	230.103636	146.3
[M+Na]+	252.085578	157.3
[M-H]-	228.089084	147.4
[M+NH4]+	247.130183	163.3
[M+K]+	268.059518	152.1
[M+H-H2O]+	212.093620	138.3
[M+HCOO]-	274.094561	168.5
[M+CH3COO]-	288.110211	158.7
[M+Na-2H]-	250.071026	155.8
[M]+	229.09581142	147.0
[M]-	229.09690858	147.0

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.