CID 83665088

2-(3-bromophenyl)-5-chlorothiophene

Structural Information

Molecular Formula
C10H6BrClS
SMILES
C1=CC(=CC(=C1)Br)C2=CC=C(S2)Cl
InChI
InChI=1S/C10H6BrClS/c11-8-3-1-2-7(6-8)9-4-5-10(12)13-9/h1-6H
InChIKey
CIXJAEZRHZAZJN-UHFFFAOYSA-N
Compound name
2-(3-bromophenyl)-5-chlorothiophene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

271.90622 Da
Monoisotopic Mass

4.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 272.91350 140.8
[M+Na]+ 294.89544 146.8
[M+NH4]+ 289.94004 148.3
[M+K]+ 310.86938 144.5
[M-H]- 270.89894 144.4
[M+Na-2H]- 292.88089 147.0
[M]+ 271.90567 142.4
[M]- 271.90677 142.4
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.