CID 16684380

Dv 50

Structural Information

Molecular Formula
C10H6ClINO2Sb
SMILES
CC1=C(C2=C(C(=C1I)O[Sb]=O)N=CC=C2)Cl
InChI
InChI=1S/C10H7ClINO.O.Sb/c1-5-7(11)6-3-2-4-13-9(6)10(14)8(5)12;;/h2-4,14H,1H3;;/q;;+1/p-1
InChIKey
FSAQRWKFXAQRBX-UHFFFAOYSA-M
Compound name
(5-chloro-7-iodo-6-methylquinolin-8-yl)oxy-oxostibane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

454.817 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 455.82428 168.9
[M+Na]+ 477.80622 173.1
[M-H]- 453.80972 164.9
[M+NH4]+ 472.85082 181.9
[M+K]+ 493.78016 173.8
[M+H-H2O]+ 437.81426 158.3
[M+HCOO]- 499.81520 181.2
[M+CH3COO]- 513.83085 203.6
[M+Na-2H]- 475.79167 162.2
[M]+ 454.81645 171.7
[M]- 454.81755 171.7
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

No patent data available for this compound.