CID 55281170

6-methylpyridazin-4-amine hydrochloride

Structural Information

Molecular Formula

C₅H₇N₃

SMILES

CC1=CC(=CN=N1)N

InChI

InChI=1S/C5H7N3/c1-4-2-5(6)3-7-8-4/h2-3H,1H3,(H2,6,8)

InChIKey

VINQTTYFIBEQCY-UHFFFAOYSA-N

Compound name

6-methylpyridazin-4-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 33
Patents: 109.063995 Da
Monoisotopic Mass: -0.4
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]+	110.07127	119.2
[M+Na]+	132.05321	128.5
[M-H]-	108.05672	120.2
[M+NH4]+	127.09782	139.2
[M+K]+	148.02715	126.9
[M+H-H2O]+	92.061255	112.5
[M+HCOO]-	154.06220	142.9
[M+CH3COO]-	168.07785	169.8
[M+Na-2H]-	130.03866	128.3
[M]+	109.06345	117.3
[M]-	109.06454	117.3

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe