CID 75817

4'-bromosalicylanilide

Structural Information

Molecular Formula
C13H10BrNO2
SMILES
C1=CC=C(C(=C1)C(=O)NC2=CC=C(C=C2)Br)O
InChI
InChI=1S/C13H10BrNO2/c14-9-5-7-10(8-6-9)15-13(17)11-3-1-2-4-12(11)16/h1-8,16H,(H,15,17)
InChIKey
DKQMTUHJJPFJRL-UHFFFAOYSA-N
Compound name
N-(4-bromophenyl)-2-hydroxybenzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

9
References

7
Patents

290.9895 Da
Monoisotopic Mass

4.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 291.99678 156.0
[M+Na]+ 313.97872 166.1
[M-H]- 289.98222 164.0
[M+NH4]+ 309.02332 174.0
[M+K]+ 329.95266 154.0
[M+H-H2O]+ 273.98676 154.7
[M+HCOO]- 335.98770 177.1
[M+CH3COO]- 350.00335 196.7
[M+Na-2H]- 311.96417 162.5
[M]+ 290.98895 173.0
[M]- 290.99005 173.0
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

No patent data available for this compound.