CID 86097939

4-(6-bromopyridazin-3-yl)morpholine

Structural Information

Molecular Formula
C8H10BrN3O
SMILES
C1COCCN1C2=NN=C(C=C2)Br
InChI
InChI=1S/C8H10BrN3O/c9-7-1-2-8(11-10-7)12-3-5-13-6-4-12/h1-2H,3-6H2
InChIKey
DGGYNJDQLBXTMA-UHFFFAOYSA-N
Compound name
4-(6-bromopyridazin-3-yl)morpholine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

79
Patents

243.00072 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 244.00800 143.0
[M+Na]+ 265.98994 153.2
[M-H]- 241.99344 148.3
[M+NH4]+ 261.03454 158.7
[M+K]+ 281.96388 143.9
[M+H-H2O]+ 225.99798 141.0
[M+HCOO]- 287.99892 158.4
[M+CH3COO]- 302.01457 156.5
[M+Na-2H]- 263.97539 152.2
[M]+ 243.00017 158.7
[M]- 243.00127 158.7
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

patents stripe