CID 75481752

4-(5-bromo-6-chloropyrazin-2-yl)morpholine

Structural Information

Molecular Formula
C8H9BrClN3O
SMILES
C1COCCN1C2=CN=C(C(=N2)Cl)Br
InChI
InChI=1S/C8H9BrClN3O/c9-7-8(10)12-6(5-11-7)13-1-3-14-4-2-13/h5H,1-4H2
InChIKey
QSSIJDROYUXWPZ-UHFFFAOYSA-N
Compound name
4-(5-bromo-6-chloropyrazin-2-yl)morpholine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

276.96176 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 277.96904 147.5
[M+Na]+ 299.95098 159.3
[M-H]- 275.95448 152.9
[M+NH4]+ 294.99558 163.0
[M+K]+ 315.92492 148.3
[M+H-H2O]+ 259.95902 145.8
[M+HCOO]- 321.95996 158.3
[M+CH3COO]- 335.97561 161.0
[M+Na-2H]- 297.93643 155.6
[M]+ 276.96121 165.2
[M]- 276.96231 165.2
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.