Spektraris NMR
Paeonilactone A
Common Name: Paeonilactone A
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C10H14O4/c1-5-6-3-8(11)10(2,13)4-7(6)14-9(5)12/h5-7,13H,3-4H2,1-2H3/t5-,6?,7?,10+/m1/s1
InChIKey: InChIKey=NODZICYHUGDVAM-QXGNCEJQSA-N
Formula: C10H14O4
Molecular Weight: 198.216149
Exact Mass: 198.089209
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Hayashi, T., Shinbo, T., Shimizu, M., Arisawa, M., Morita, N., Kimura, M., Matsuda, S., Kikuchi, T. Tetrahedron Lett (1985) 26, 3699-702
Species:
Notes: Family : Terpenoids, Type : Monoterpenoids, Group : p-Menthanes; 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 |
|---|---|
| 1 (C) | 73.6 |
| 2 (CH2) | 42.4 |
| 3 (CH) | 73.6 |
| 4 (CH) | 37.9 |
| 5 (CH2) | 35.6 |
| 6 (C) | 210.6 |
| 7 (CH3) | 25 |
| 8 (CH) | 44.2 |
| 9 (C) | 170 |
| 10 (CH3) | 13.3 |
