CID 362894

4,6-dichloro-2,1,3-benzoselenadiazole

Structural Information

Molecular Formula
C6H2Cl2N2Se
SMILES
C1=C(C=C(C2=N[Se]N=C21)Cl)Cl
InChI
InChI=1S/C6H2Cl2N2Se/c7-3-1-4(8)6-5(2-3)9-11-10-6/h1-2H
InChIKey
GLOCDVPHEOJWHD-UHFFFAOYSA-N
Compound name
4,6-dichloro-2,1,3-benzoselenadiazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

251.87604 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 252.88332 143.3
[M+Na]+ 274.86526 156.4
[M-H]- 250.86876 144.6
[M+NH4]+ 269.90986 164.3
[M+K]+ 290.83920 150.5
[M+H-H2O]+ 234.87330 136.8
[M+HCOO]- 296.87424 157.2
[M+CH3COO]- 310.88989 156.9
[M+Na-2H]- 272.85071 149.8
[M]+ 251.87549 147.8
[M]- 251.87659 147.8
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.