CID 3039775

5-benzoxazoleacetamide, alpha-methyl-2-phenyl-

Structural Information

Molecular Formula
C16H14N2O2
SMILES
CC(C1=CC2=C(C=C1)OC(=N2)C3=CC=CC=C3)C(=O)N
InChI
InChI=1S/C16H14N2O2/c1-10(15(17)19)12-7-8-14-13(9-12)18-16(20-14)11-5-3-2-4-6-11/h2-10H,1H3,(H2,17,19)
InChIKey
CLSKZQOZXBYSJE-UHFFFAOYSA-N
Compound name
2-(2-phenyl-1,3-benzoxazol-5-yl)propanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

6
Patents

266.10553 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 267.112806 160.4
[M+Na]+ 289.094748 169.1
[M-H]- 265.098254 167.7
[M+NH4]+ 284.139353 176.4
[M+K]+ 305.068688 166.0
[M+H-H2O]+ 249.102790 152.5
[M+HCOO]- 311.103731 182.9
[M+CH3COO]- 325.119381 173.0
[M+Na-2H]- 287.080196 165.0
[M]+ 266.10498142 162.3
[M]- 266.10607858 162.3
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