Spektraris NMR
2-Methyl-4-pyrone
Common Name: 2-Methyl-4-pyrone
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C6H6O2/c1-5-4-6(7)2-3-8-5/h2-4H,1H3
InChIKey: InChIKey=NQOJWZRPLXJDPX-UHFFFAOYSA-N
Formula: C6H6O2
Molecular Weight: 110.11087
Exact Mass: 110.036779
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Svensson M., Lundgren L.N., Woods C., Fatehi J., Stenlid J. Phytochemistry (2001) 56, 747-51
Species:
Notes: Family : Pyranes, Type : Pyrones; 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) | 166.7 |
| 3 (CH) | 115.5 |
| 4 (C) | 179.3 |
| 5 (CH) | 116.6 |
| 6 (CH) | 155.4 |
| 2a (CH3) | 20 |
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The Spektraris NMR database is developed and hosted by the Lange laboratory at WSU. CAS Registry Number is a Registered Trademark of the American Chemical Society.