CID 2795380

2567495-40-1

Structural Information

Molecular Formula

C₉H₁₆N₄O

SMILES

CC1=NN(C(=C1N)N2CCOCC2)C

InChI

InChI=1S/C9H16N4O/c1-7-8(10)9(12(2)11-7)13-3-5-14-6-4-13/h3-6,10H2,1-2H3

InChIKey

LEVZXNJICHTQEC-UHFFFAOYSA-N

Compound name

1,3-dimethyl-5-morpholin-4-ylpyrazol-4-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 4
Patents: 196.13242 Da
Monoisotopic Mass: 0.0
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]+	197.13970	145.7
[M+Na]+	219.12164	153.4
[M-H]-	195.12514	148.6
[M+NH4]+	214.16624	161.2
[M+K]+	235.09558	152.0
[M+H-H2O]+	179.12968	137.0
[M+HCOO]-	241.13062	163.9
[M+CH3COO]-	255.14627	185.9
[M+Na-2H]-	217.10709	148.4
[M]+	196.13187	142.5
[M]-	196.13297	142.5

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe