CID 4277662

886-31-7

Structural Information

Molecular Formula
C13H10BrNO
SMILES
C1=CC=C(C(=C1)C=NC2=CC(=CC=C2)Br)O
InChI
InChI=1S/C13H10BrNO/c14-11-5-3-6-12(8-11)15-9-10-4-1-2-7-13(10)16/h1-9,16H
InChIKey
WZMRGZLLMIKMQL-UHFFFAOYSA-N
Compound name
2-[(3-bromophenyl)iminomethyl]phenol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

7
Patents

274.99457 Da
Monoisotopic Mass

3.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 276.00185 151.5
[M+Na]+ 297.98379 156.9
[M+NH4]+ 293.02839 157.1
[M+K]+ 313.95773 154.9
[M-H]- 273.98729 155.2
[M+Na-2H]- 295.96924 158.3
[M]+ 274.99402 152.3
[M]- 274.99512 152.3
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