CID 381908

4-azido-2-chloro-3-phenyl-quinoline

Structural Information

Molecular Formula
C15H9ClN4
SMILES
C1=CC=C(C=C1)C2=C(C3=CC=CC=C3N=C2Cl)N=[N+]=[N-]
InChI
InChI=1S/C15H9ClN4/c16-15-13(10-6-2-1-3-7-10)14(19-20-17)11-8-4-5-9-12(11)18-15/h1-9H
InChIKey
HYVQFVOAQXURAR-UHFFFAOYSA-N
Compound name
4-azido-2-chloro-3-phenylquinoline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

280.05157 Da
Monoisotopic Mass

5.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 281.05885 162.0
[M+Na]+ 303.04079 170.8
[M-H]- 279.04429 170.4
[M+NH4]+ 298.08539 178.2
[M+K]+ 319.01473 160.0
[M+H-H2O]+ 263.04883 157.3
[M+HCOO]- 325.04977 186.2
[M+CH3COO]- 339.06542 202.6
[M+Na-2H]- 301.02624 173.4
[M]+ 280.05102 162.0
[M]- 280.05212 162.0
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

No patent data available for this compound.