CID 348936

4-iododibenzoselenophene

Structural Information

Molecular Formula
C12H7ISe
SMILES
C1=CC=C2C(=C1)C3=C([Se]2)C(=CC=C3)I
InChI
InChI=1S/C12H7ISe/c13-10-6-3-5-9-8-4-1-2-7-11(8)14-12(9)10/h1-7H
InChIKey
FBTSSHSQSPYTJQ-UHFFFAOYSA-N
Compound name
4-iododibenzoselenophene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

31
Patents

357.87576 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 358.88304 149.7
[M+Na]+ 380.86498 153.2
[M-H]- 356.86848 148.1
[M+NH4]+ 375.90958 168.1
[M+K]+ 396.83892 154.0
[M+H-H2O]+ 340.87302 140.0
[M+HCOO]- 402.87396 168.9
[M+CH3COO]- 416.88961 159.7
[M+Na-2H]- 378.85043 145.9
[M]+ 357.87521 148.8
[M]- 357.87631 148.8
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe