CID 16619

2,7-dichloronaphthalene

Structural Information

Molecular Formula
C10H6Cl2
SMILES
C1=CC(=CC2=C1C=CC(=C2)Cl)Cl
InChI
InChI=1S/C10H6Cl2/c11-9-3-1-7-2-4-10(12)6-8(7)5-9/h1-6H
InChIKey
DWBQZSYTSNYEEJ-UHFFFAOYSA-N
Compound name
2,7-dichloronaphthalene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

3
References

70
Patents

195.98465 Da
Monoisotopic Mass

4.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 196.99193 134.2
[M+Na]+ 218.97387 152.2
[M+NH4]+ 214.01847 146.0
[M+K]+ 234.94781 142.1
[M-H]- 194.97737 138.8
[M+Na-2H]- 216.95932 144.1
[M]+ 195.98410 139.0
[M]- 195.98520 139.0
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