CID 70058

2-(1-naphthyl)-5-phenyloxazole

Structural Information

Molecular Formula
C19H13NO
SMILES
C1=CC=C(C=C1)C2=CN=C(O2)C3=CC=CC4=CC=CC=C43
InChI
InChI=1S/C19H13NO/c1-2-8-15(9-3-1)18-13-20-19(21-18)17-12-6-10-14-7-4-5-11-16(14)17/h1-13H
InChIKey
WWVFJJKBBZXWFV-UHFFFAOYSA-N
Compound name
2-naphthalen-1-yl-5-phenyl-1,3-oxazole
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

2
References

1828
Patents

271.0997 Da
Monoisotopic Mass

5.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 272.10698 161.0
[M+Na]+ 294.08892 180.4
[M+NH4]+ 289.13352 171.6
[M+K]+ 310.06286 171.9
[M-H]- 270.09242 170.4
[M+Na-2H]- 292.07437 174.0
[M]+ 271.09915 166.9
[M]- 271.10025 166.9
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