CID 712698

N-(2-phenyl-1,3-benzoxazol-5-yl)benzamide

Structural Information

Molecular Formula
C20H14N2O2
SMILES
C1=CC=C(C=C1)C2=NC3=C(O2)C=CC(=C3)NC(=O)C4=CC=CC=C4
InChI
InChI=1S/C20H14N2O2/c23-19(14-7-3-1-4-8-14)21-16-11-12-18-17(13-16)22-20(24-18)15-9-5-2-6-10-15/h1-13H,(H,21,23)
InChIKey
FDVPIOYDRRNLPY-UHFFFAOYSA-N
Compound name
N-(2-phenyl-1,3-benzoxazol-5-yl)benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

4
References

62
Patents

314.10553 Da
Monoisotopic Mass

4.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 315.11281 171.7
[M+Na]+ 337.09475 180.3
[M-H]- 313.09825 182.4
[M+NH4]+ 332.13935 185.4
[M+K]+ 353.06869 175.6
[M+H-H2O]+ 297.10279 162.3
[M+HCOO]- 359.10373 195.6
[M+CH3COO]- 373.11938 183.8
[M+Na-2H]- 335.08020 178.5
[M]+ 314.10498 173.8
[M]- 314.10608 173.8
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