CID 14553

Dipyrido(1,2-a:2',1'-c)pyrazinediium, dibromide, monohydrate

Structural Information

Molecular Formula
C12H10N2
SMILES
C1=CC2=C3C=CC=CN3C=CN2C=C1
InChI
InChI=1S/C12H10N2/c1-3-7-13-9-10-14-8-4-2-6-12(14)11(13)5-1/h1-10H
InChIKey
MSDXGKHMUSAIHM-UHFFFAOYSA-N
Compound name
7,10-diazatricyclo[8.4.0.02,7]tetradeca-1,3,5,8,11,13-hexaene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

182.0844 Da
Monoisotopic Mass

3.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 183.09168 138.0
[M+Na]+ 205.07362 154.5
[M+NH4]+ 200.11822 148.7
[M+K]+ 221.04756 145.4
[M-H]- 181.07712 141.9
[M+Na-2H]- 203.05907 147.1
[M]+ 182.08385 141.7
[M]- 182.08495 141.7
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