CID 6483888

1-(1h-pyrazol-1-yl)propan-2-amine

Structural Information

Molecular Formula

C₆H₁₁N₃

SMILES

CC(CN1C=CC=N1)N

InChI

InChI=1S/C6H11N3/c1-6(7)5-9-4-2-3-8-9/h2-4,6H,5,7H2,1H3

InChIKey

UWVUXGHAXNILPG-UHFFFAOYSA-N

Compound name

1-pyrazol-1-ylpropan-2-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 2
References: 83
Patents: 125.0953 Da
Monoisotopic Mass: -1.0
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]+	126.10258	125.5
[M+Na]+	148.08452	135.6
[M+NH4]+	143.12912	133.4
[M+K]+	164.05846	132.4
[M-H]-	124.08802	126.1
[M+Na-2H]-	146.06997	131.1
[M]+	125.09475	126.8
[M]-	125.09585	126.8

Literature stripe

literature stripe

Patent stripe

patents stripe