CID 353380

Nsc601359

Structural Information

Molecular Formula
C21H14BrNO2
SMILES
C1=CC=C2C(=C1)C=CC(=C2O)C(=O)NC3=CC=C(C4=CC=CC=C43)Br
InChI
InChI=1S/C21H14BrNO2/c22-18-11-12-19(16-8-4-3-7-15(16)18)23-21(25)17-10-9-13-5-1-2-6-14(13)20(17)24/h1-12,24H,(H,23,25)
InChIKey
FXYXGRSAQZGIOS-UHFFFAOYSA-N
Compound name
N-(4-bromonaphthalen-1-yl)-1-hydroxynaphthalene-2-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

7
References

23
Patents

391.02078 Da
Monoisotopic Mass

6.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 392.02806 184.8
[M+Na]+ 414.01000 195.6
[M-H]- 390.01350 194.3
[M+NH4]+ 409.05460 200.6
[M+K]+ 429.98394 182.5
[M+H-H2O]+ 374.01804 182.4
[M+HCOO]- 436.01898 203.6
[M+CH3COO]- 450.03463 196.9
[M+Na-2H]- 411.99545 192.1
[M]+ 391.02023 203.5
[M]- 391.02133 203.5
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