CID 346051

N-(4-bromophenyl)-4-methoxybenzamide

Structural Information

Molecular Formula
C14H12BrNO2
SMILES
COC1=CC=C(C=C1)C(=O)NC2=CC=C(C=C2)Br
InChI
InChI=1S/C14H12BrNO2/c1-18-13-8-2-10(3-9-13)14(17)16-12-6-4-11(15)5-7-12/h2-9H,1H3,(H,16,17)
InChIKey
QDYDNKAVIIBNDO-UHFFFAOYSA-N
Compound name
N-(4-bromophenyl)-4-methoxybenzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

18
Patents

305.00513 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 306.01241 160.0
[M+Na]+ 327.99435 170.1
[M-H]- 303.99785 169.2
[M+NH4]+ 323.03895 178.2
[M+K]+ 343.96829 158.7
[M+H-H2O]+ 288.00239 158.4
[M+HCOO]- 350.00333 182.2
[M+CH3COO]- 364.01898 201.8
[M+Na-2H]- 325.97980 166.5
[M]+ 305.00458 179.0
[M]- 305.00568 179.0
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