Spektraris NMR
(1S,9R)-6-(Hydroxymethyl)-2-methyl-10-methylene-12-oxatricyclo[7.3.1.01,5]trideca-2,5-diene-4,11-dione
![(1S,9R)-6-(Hydroxymethyl)-2-methyl-10-methylene-12-oxatricyclo[7.3.1.01,5]trideca-2,5-diene-4,11-dione](/nmr/static/nmr/svg/10088.svg)
Common Name: (1S,9R)-6-(Hydroxymethyl)-2-methyl-10-methylene-12-oxatricyclo[7.3.1.01,5]trideca-2,5-diene-4,11-dione
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C15H16O4/c1-8-5-12(17)13-11(7-16)4-3-10-6-15(8,13)19-14(18)9(10)2/h5,10,16H,2-4,6-7H2,1H3/t10-,15+/m1/s1
InChIKey: InChIKey=SPZKJZJNPQNEKT-BMIGLBTASA-N
Formula: C15H16O4
Molecular Weight: 260.28571
Exact Mass: 260.104859
NMR Solvent: CD3OD
MHz:
Calibration:
NMR references: 13C - Zidorn, C., Ellmerer-Muller, E.P., Stuppner, H. Phytochemistry (1998) 49, 797-800
Species:
Notes: Family : Terpenoids, Type : Sesquiterpenoids, Group : Guaianes; 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) | 137.1 |
| 2 (C) | 195.2 |
| 3 (CH) | 136 |
| 4 (C) | 171.5 |
| 5 (C) | 91 |
| 6 (CH2) | 33.4 |
| 7 (CH) | 39 |
| 8 (CH2) | 35.1 |
| 9 (CH2) | 26 |
| 10 (C) | 157.9 |
| 11 (C) | 138.9 |
| 12 (C) | 167.3 |
| 13 (CH2) | 131 |
| 14 (CH2) | 61.5 |
| 15 (CH3) | 13 |
