CID 3563674

2-(3-pyridyl)benzoselenazole

Structural Information

Molecular Formula
C12H8N2Se
SMILES
C1=CC=C2C(=C1)N=C([Se]2)C3=CN=CC=C3
InChI
InChI=1S/C12H8N2Se/c1-2-6-11-10(5-1)14-12(15-11)9-4-3-7-13-8-9/h1-8H
InChIKey
HYKUGBHJUOOCKO-UHFFFAOYSA-N
Compound name
2-pyridin-3-yl-1,3-benzoselenazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

259.98526 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 260.99254 150.0
[M+Na]+ 282.97448 166.7
[M+NH4]+ 278.01908 159.9
[M+K]+ 298.94842 158.9
[M-H]- 258.97798 154.7
[M+Na-2H]- 280.95993 160.6
[M]+ 259.98471 153.9
[M]- 259.98581 153.9
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.