CID 102043998

N-cyano-1h-pyrazole-1-carboximidamide

Structural Information

Molecular Formula

C₅H₅N₅

SMILES

C1=CN(N=C1)C(=NC#N)N

InChI

InChI=1S/C5H5N5/c6-4-8-5(7)10-3-1-2-9-10/h1-3H,(H2,7,8)

InChIKey

AEZMULLNGFOGHM-UHFFFAOYSA-N

Compound name

N'-cyanopyrazole-1-carboximidamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 135.05449 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]+	136.061766	126.6
[M+Na]+	158.043708	135.4
[M-H]-	134.047214	127.5
[M+NH4]+	153.088313	144.5
[M+K]+	174.017648	134.6
[M+H-H2O]+	118.051750	111.4
[M+HCOO]-	180.052691	148.2
[M+CH3COO]-	194.068341	189.1
[M+Na-2H]-	156.029156	132.7
[M]+	135.05394142	119.3
[M]-	135.05503858	119.3

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.