CID 2384284

3-(4-propylphenyl)-1h-pyrazol-5-amine

Structural Information

Molecular Formula

C₁₂H₁₅N₃

SMILES

CCCC1=CC=C(C=C1)C2=CC(=NN2)N

InChI

InChI=1S/C12H15N3/c1-2-3-9-4-6-10(7-5-9)11-8-12(13)15-14-11/h4-8H,2-3H2,1H3,(H3,13,14,15)

InChIKey

ZKXPZJHRBDVHIA-UHFFFAOYSA-N

Compound name

5-(4-propylphenyl)-1H-pyrazol-3-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 7
References: 0
Patents: 201.1266 Da
Monoisotopic Mass: 2.9
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]+	202.13388	146.0
[M+Na]+	224.11582	158.5
[M+NH4]+	219.16042	154.0
[M+K]+	240.08976	153.4
[M-H]-	200.11932	149.2
[M+Na-2H]-	222.10127	153.6
[M]+	201.12605	148.5
[M]-	201.12715	148.5

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.