CID 42281880

1152841-43-4

Structural Information

Molecular Formula

C₉H₁₈N₄

SMILES

CCN(CC)CCN1C=C(C=N1)N

InChI

InChI=1S/C9H18N4/c1-3-12(4-2)5-6-13-8-9(10)7-11-13/h7-8H,3-6,10H2,1-2H3

InChIKey

MWQSJRTXOKYCHJ-UHFFFAOYSA-N

Compound name

1-[2-(diethylamino)ethyl]pyrazol-4-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 28
Patents: 182.15315 Da
Monoisotopic Mass: 0.3
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]+	183.16043	141.9
[M+Na]+	205.14237	151.0
[M+NH4]+	200.18697	149.1
[M+K]+	221.11631	147.5
[M-H]-	181.14587	143.2
[M+Na-2H]-	203.12782	146.8
[M]+	182.15260	143.2
[M]-	182.15370	143.2

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe