CID 15307665

Diphenyl-1,3-oxazole-4-carboxylic acid

Structural Information

Molecular Formula
C16H11NO3
SMILES
C1=CC=C(C=C1)C2=C(N=C(O2)C3=CC=CC=C3)C(=O)O
InChI
InChI=1S/C16H11NO3/c18-16(19)13-14(11-7-3-1-4-8-11)20-15(17-13)12-9-5-2-6-10-12/h1-10H,(H,18,19)
InChIKey
YKZSHSBBYKLXNM-UHFFFAOYSA-N
Compound name
2,5-diphenyl-1,3-oxazole-4-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

25
Patents

265.07388 Da
Monoisotopic Mass

3.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 266.08116 158.8
[M+Na]+ 288.06310 174.0
[M+NH4]+ 283.10770 166.7
[M+K]+ 304.03704 169.2
[M-H]- 264.06660 165.0
[M+Na-2H]- 286.04855 168.4
[M]+ 265.07333 162.8
[M]- 265.07443 162.8
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