CID 73101

Picolinic acid, 2-benzylhydrazide

Structural Information

Molecular Formula

C₁₃H₁₃N₃O

SMILES

C1=CC=C(C=C1)CNNC(=O)C2=CC=CC=N2

InChI

InChI=1S/C13H13N3O/c17-13(12-8-4-5-9-14-12)16-15-10-11-6-2-1-3-7-11/h1-9,15H,10H2,(H,16,17)

InChIKey

MAUBFEHMBSQXMM-UHFFFAOYSA-N

Compound name

N'-benzylpyridine-2-carbohydrazide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 5
References: 2
Patents: 227.10587 Da
Monoisotopic Mass: 1.7
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]+	228.11315	151.5
[M+Na]+	250.09509	164.0
[M+NH4]+	245.13969	159.4
[M+K]+	266.06903	156.8
[M-H]-	226.09859	156.2
[M+Na-2H]-	248.08054	161.4
[M]+	227.10532	154.4
[M]-	227.10642	154.4

Literature stripe

literature stripe

Patent stripe

patents stripe