CID 60859181

6-chloro-n-ethylpyridazine-3-carboxamide

Structural Information

Molecular Formula

C₇H₈ClN₃O

SMILES

CCNC(=O)C1=NN=C(C=C1)Cl

InChI

InChI=1S/C7H8ClN3O/c1-2-9-7(12)5-3-4-6(8)11-10-5/h3-4H,2H2,1H3,(H,9,12)

InChIKey

ZDSUIAKOLYRNLN-UHFFFAOYSA-N

Compound name

6-chloro-N-ethylpyridazine-3-carboxamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 2
Patents: 185.03558 Da
Monoisotopic Mass: 0.8
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]+	186.04286	135.7
[M+Na]+	208.02480	148.7
[M+NH4]+	203.06940	143.3
[M+K]+	223.99874	142.6
[M-H]-	184.02830	136.8
[M+Na-2H]-	206.01025	142.7
[M]+	185.03503	137.9
[M]-	185.03613	137.9

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe