CID 20118714

913839-68-6

Structural Information

Molecular Formula

C₆H₆N₄

SMILES

C1=CN=C(C=C1C#N)NN

InChI

InChI=1S/C6H6N4/c7-4-5-1-2-9-6(3-5)10-8/h1-3H,8H2,(H,9,10)

InChIKey

PMRMKCHJLLVOQU-UHFFFAOYSA-N

Compound name

2-hydrazinylpyridine-4-carbonitrile

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 45
Patents: 134.05925 Da
Monoisotopic Mass: 0.1
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]+	135.066526	127.1
[M+Na]+	157.048468	136.4
[M-H]-	133.051974	128.6
[M+NH4]+	152.093073	144.6
[M+K]+	173.022408	134.4
[M+H-H2O]+	117.056510	113.8
[M+HCOO]-	179.057451	148.6
[M+CH3COO]-	193.073101	189.1
[M+Na-2H]-	155.033916	134.9
[M]+	134.05870142	119.3
[M]-	134.05979858	119.3

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe