CID 119009146

2-chloro-6-iodonaphthalene

Structural Information

Molecular Formula
C10H6ClI
SMILES
C1=CC2=C(C=CC(=C2)I)C=C1Cl
InChI
InChI=1S/C10H6ClI/c11-9-3-1-8-6-10(12)4-2-7(8)5-9/h1-6H
InChIKey
LKWKYFPFZOBUIC-UHFFFAOYSA-N
Compound name
2-chloro-6-iodonaphthalene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

5
Patents

287.9203 Da
Monoisotopic Mass

4.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 288.92758 135.4
[M+Na]+ 310.90952 139.1
[M-H]- 286.91302 133.0
[M+NH4]+ 305.95412 152.7
[M+K]+ 326.88346 140.0
[M+H-H2O]+ 270.91756 127.2
[M+HCOO]- 332.91850 150.0
[M+CH3COO]- 346.93415 145.8
[M+Na-2H]- 308.89497 132.6
[M]+ 287.91975 134.7
[M]- 287.92085 134.7
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

patents stripe