CID 63214

Brn 1594313

Structural Information

Molecular Formula

C₁₆H₁₆N₄O₂

SMILES

CCOC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2NN

InChI

InChI=1S/C16H16N4O2/c1-2-22-12-9-7-11(8-10-12)20-15(21)13-5-3-4-6-14(13)18-16(20)19-17/h3-10H,2,17H2,1H3,(H,18,19)

InChIKey

WIRMTKGJURVNOP-UHFFFAOYSA-N

Compound name

3-(4-ethoxyphenyl)-2-hydrazinylquinazolin-4-one

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 296.12732 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]+	297.134596	167.7
[M+Na]+	319.116538	176.9
[M-H]-	295.120044	172.8
[M+NH4]+	314.161143	180.6
[M+K]+	335.090478	171.5
[M+H-H2O]+	279.124580	157.7
[M+HCOO]-	341.125521	190.4
[M+CH3COO]-	355.141171	178.9
[M+Na-2H]-	317.101986	175.1
[M]+	296.12677142	168.5
[M]-	296.12786858	168.5

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.