CID 91618741

2727-12-0

Structural Information

Molecular Formula

C₅H₆ClN₅O

SMILES

C1=C(N=C(C(=N1)N)C(=O)NN)Cl

InChI

InChI=1S/C5H6ClN5O/c6-2-1-9-4(7)3(10-2)5(12)11-8/h1H,8H2,(H2,7,9)(H,11,12)

InChIKey

NTNVOTMFLWJGJG-UHFFFAOYSA-N

Compound name

3-amino-6-chloropyrazine-2-carbohydrazide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 1
Patents: 187.0261 Da
Monoisotopic Mass: -0.2
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]+	188.03338	136.3
[M+Na]+	210.01532	145.5
[M-H]-	186.01882	137.1
[M+NH4]+	205.05992	153.1
[M+K]+	225.98926	142.0
[M+H-H2O]+	170.02336	129.6
[M+HCOO]-	232.02430	156.2
[M+CH3COO]-	246.03995	186.0
[M+Na-2H]-	208.00077	142.4
[M]+	187.02555	134.2
[M]-	187.02665	134.2

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe