CID 12857236

7-bromoquinolin-6-ol hydrobromide

Structural Information

Molecular Formula
C9H6BrNO
SMILES
C1=CC2=CC(=C(C=C2N=C1)Br)O
InChI
InChI=1S/C9H6BrNO/c10-7-5-8-6(4-9(7)12)2-1-3-11-8/h1-5,12H
InChIKey
FJWCPOBQDFEVJT-UHFFFAOYSA-N
Compound name
7-bromoquinolin-6-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

22
Patents

222.96329 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 223.970566 136.7
[M+Na]+ 245.952508 149.8
[M-H]- 221.956014 141.9
[M+NH4]+ 240.997113 158.1
[M+K]+ 261.926448 138.2
[M+H-H2O]+ 205.960550 137.1
[M+HCOO]- 267.961491 156.3
[M+CH3COO]- 281.977141 152.1
[M+Na-2H]- 243.937956 147.2
[M]+ 222.96274142 155.0
[M]- 222.96383858 155.0
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