CID 136656584

2260937-08-2

Structural Information

Molecular Formula

C₇H₈N₄

SMILES

CN1C=CC(=N1)C2=CNN=C2

InChI

InChI=1S/C7H8N4/c1-11-3-2-7(10-11)6-4-8-9-5-6/h2-5H,1H3,(H,8,9)

InChIKey

FVWMEPWXBRKKJQ-UHFFFAOYSA-N

Compound name

1-methyl-3-(1H-pyrazol-4-yl)pyrazole

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 2
Patents: 148.07489 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]+	149.08217	128.1
[M+Na]+	171.06411	141.2
[M+NH4]+	166.10871	135.6
[M+K]+	187.03805	139.3
[M-H]-	147.06761	128.9
[M+Na-2H]-	169.04956	136.2
[M]+	148.07434	130.0
[M]-	148.07544	130.0

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe