CID 321879

66974-78-5

Structural Information

Molecular Formula

C₁₀H₁₄N₄O₂

SMILES

CN(C)N=NC1=C(C=CC(=C1)C(=O)N)OC

InChI

InChI=1S/C10H14N4O2/c1-14(2)13-12-8-6-7(10(11)15)4-5-9(8)16-3/h4-6H,1-3H3,(H2,11,15)

InChIKey

DGNRILCIMHRIOR-UHFFFAOYSA-N

Compound name

3-(dimethylaminodiazenyl)-4-methoxybenzamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 2
Patents: 222.11168 Da
Monoisotopic Mass: 0.4
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]+	223.11896	148.3
[M+Na]+	245.10090	154.9
[M-H]-	221.10440	156.0
[M+NH4]+	240.14550	167.2
[M+K]+	261.07484	155.9
[M+H-H2O]+	205.10894	140.2
[M+HCOO]-	267.10988	179.2
[M+CH3COO]-	281.12553	207.2
[M+Na-2H]-	243.08635	153.6
[M]+	222.11113	151.0
[M]-	222.11223	151.0

Literature stripe

literature stripe

Patent stripe

patents stripe