CID 20511349

3-(hydrazinylmethyl)benzonitrile hydrochloride

Structural Information

Molecular Formula

C₈H₉N₃

SMILES

C1=CC(=CC(=C1)C#N)CNN

InChI

InChI=1S/C8H9N3/c9-5-7-2-1-3-8(4-7)6-11-10/h1-4,11H,6,10H2

InChIKey

DXDXOQIXPHKNSS-UHFFFAOYSA-N

Compound name

3-(hydrazinylmethyl)benzonitrile

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 48
Patents: 147.07965 Da
Monoisotopic Mass: 0.3
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]+	148.08693	135.4
[M+Na]+	170.06887	146.1
[M+NH4]+	165.11347	140.5
[M+K]+	186.04281	136.7
[M-H]-	146.07237	131.3
[M+Na-2H]-	168.05432	139.8
[M]+	147.07910	134.8
[M]-	147.08020	134.8

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe