CID 96629

63884-58-2

Structural Information

Molecular Formula

C₈H₁₁N₃O

SMILES

CN(C)NC(=O)C1=CC=NC=C1

InChI

InChI=1S/C8H11N3O/c1-11(2)10-8(12)7-3-5-9-6-4-7/h3-6H,1-2H3,(H,10,12)

InChIKey

KBKSQARHBWLOTQ-UHFFFAOYSA-N

Compound name

N',N'-dimethylpyridine-4-carbohydrazide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 3
Patents: 165.09021 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]+	166.09749	134.3
[M+Na]+	188.07943	140.7
[M-H]-	164.08293	138.1
[M+NH4]+	183.12403	153.5
[M+K]+	204.05337	140.6
[M+H-H2O]+	148.08747	126.9
[M+HCOO]-	210.08841	160.0
[M+CH3COO]-	224.10406	185.5
[M+Na-2H]-	186.06488	141.8
[M]+	165.08966	134.2
[M]-	165.09076	134.2

Literature stripe

literature stripe

Patent stripe

patents stripe