Spektraris NMR
5-(4-METHOXYPHENYL)-2-PHENYLOXAZOLE
Common Name: 5-(4-METHOXYPHENYL)-2-PHENYLOXAZOLE
Synonyms: 5-(4-METHOXYPHENYL)-2-PHENYLOXAZOLE
CAS Registry Number:
InChI: InChI=1S/C16H13NO2/c1-18-14-9-7-12(8-10-14)15-11-17-16(19-15)13-5-3-2-4-6-13/h2-11H,1H3
InChIKey: InChIKey=ONQKZEWRQOTVRA-UHFFFAOYSA-N
Formula: C16H13N1O2
Molecular Weight: 251.280557
Exact Mass: 251.094629
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Cheplogoi, P.K., Mulholland, D.A., Coombes, P.H., Randrianarivelojosia, M. Phytochemistry (2008) 69, 1384-8
Species:
Notes: Family : Alkaloids, Type : Oxazols; 13 C Spectrum from Naproc 13: José Luis López-Pérez, Roberto Therón, Esther del Olmo, David Díaz: NAPROC-13: a database for the dereplication of natural product mixtures in bioassay-guided protocols. Bioinformatics 23(23):3256-3257 (2007)
Carbon NMR Peaks
| Position | PPM |
|---|---|
| 2 (C) | 160.6 |
| 4 (CH) | 121.9 |
| 5 (C) | 151.3 |
| 1' (C) | 127.6 |
| 2' (CH) | 126.1 |
| 3' (CH) | 128.8 |
| 4' (CH) | 130.1 |
| 5' (CH) | 128.8 |
| 6' (CH) | 126.1 |
| 1'' (C) | 120.9 |
| 2'' (CH) | 125.7 |
| 3'' (CH) | 114.4 |
| 4'' (C) | 159.8 |
| 5'' (CH) | 114.4 |
| 6'' (CH) | 125.7 |
| 4''a (CH3) | 55.4 |
