CID 11264312

334828-10-3

Structural Information

Molecular Formula

C₉H₁₆N₄O₂

SMILES

CCC1=C(C(=NN1CCOC)C(=O)N)N

InChI

InChI=1S/C9H16N4O2/c1-3-6-7(10)8(9(11)14)12-13(6)4-5-15-2/h3-5,10H2,1-2H3,(H2,11,14)

InChIKey

GHKYDKKHTDOYEI-UHFFFAOYSA-N

Compound name

4-amino-5-ethyl-1-(2-methoxyethyl)pyrazole-3-carboxamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 61
Patents: 212.12732 Da
Monoisotopic Mass: -0.1
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]+	213.13460	147.8
[M+Na]+	235.11654	155.9
[M+NH4]+	230.16114	153.0
[M+K]+	251.09048	154.4
[M-H]-	211.12004	147.3
[M+Na-2H]-	233.10199	150.0
[M]+	212.12677	148.2
[M]-	212.12787	148.2

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe