CID 28064827

4-[(6-chloro-2-pyrazinyl)carbonyl]morpholine

Structural Information

Molecular Formula

C₉H₁₀ClN₃O₂

SMILES

C1COCCN1C(=O)C2=CN=CC(=N2)Cl

InChI

InChI=1S/C9H10ClN3O2/c10-8-6-11-5-7(12-8)9(14)13-1-3-15-4-2-13/h5-6H,1-4H2

InChIKey

CECQGRYOHPHEPN-UHFFFAOYSA-N

Compound name

(6-chloropyrazin-2-yl)-morpholin-4-ylmethanone

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 3
Patents: 227.04616 Da
Monoisotopic Mass: 0.2
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]+	228.053436	146.9
[M+Na]+	250.035378	154.2
[M-H]-	226.038884	149.3
[M+NH4]+	245.079983	159.8
[M+K]+	266.009318	151.8
[M+H-H2O]+	210.043420	137.8
[M+HCOO]-	272.044361	158.5
[M+CH3COO]-	286.060011	158.0
[M+Na-2H]-	248.020826	152.8
[M]+	227.04561142	145.7
[M]-	227.04670858	145.7

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe