CID 66545210

4-(3,5-dibromopyridin-2-yl)morpholine

Structural Information

Molecular Formula
C9H10Br2N2O
SMILES
C1COCCN1C2=C(C=C(C=N2)Br)Br
InChI
InChI=1S/C9H10Br2N2O/c10-7-5-8(11)9(12-6-7)13-1-3-14-4-2-13/h5-6H,1-4H2
InChIKey
FFPQAQCDPWWXTJ-UHFFFAOYSA-N
Compound name
4-(3,5-dibromopyridin-2-yl)morpholine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

319.916 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 320.92328 144.0
[M+Na]+ 342.90522 153.5
[M-H]- 318.90872 151.2
[M+NH4]+ 337.94982 159.4
[M+K]+ 358.87916 140.0
[M+H-H2O]+ 302.91326 151.7
[M+HCOO]- 364.91420 156.2
[M+CH3COO]- 378.92985 157.2
[M+Na-2H]- 340.89067 151.8
[M]+ 319.91545 176.1
[M]- 319.91655 176.1
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.