CID 3073008

145440-86-4

Structural Information

Molecular Formula
C17H14N2O2
SMILES
CC1=CC(=NO1)C(=O)NC2=CC=CC=C2C3=CC=CC=C3
InChI
InChI=1S/C17H14N2O2/c1-12-11-16(19-21-12)17(20)18-15-10-6-5-9-14(15)13-7-3-2-4-8-13/h2-11H,1H3,(H,18,20)
InChIKey
KFJJOVARXGKNFZ-UHFFFAOYSA-N
Compound name
5-methyl-N-(2-phenylphenyl)-1,2-oxazole-3-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

278.10553 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 279.112806 163.5
[M+Na]+ 301.094748 171.1
[M-H]- 277.098254 173.1
[M+NH4]+ 296.139353 177.9
[M+K]+ 317.068688 167.8
[M+H-H2O]+ 261.102790 154.6
[M+HCOO]- 323.103731 187.4
[M+CH3COO]- 337.119381 175.9
[M+Na-2H]- 299.080196 168.2
[M]+ 278.10498142 164.5
[M]- 278.10607858 164.5
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.