Spektraris NMR
Nardiin
Common Name: Nardiin
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C20H30O2/c1-11-13-9-12-5-6-15-19(2,3)8-7-16(21)20(15,4)17(12)14(10-13)18(11)22/h13-16,18,21-22H,1,5-10H2,2-4H3/t13-,14-,15?,16-,18-,20-/m0/s1
InChIKey: InChIKey=URVFGKXGZYZPLZ-RSUXDMLUSA-N
Formula: C20H30O2
Molecular Weight: 302.45175
Exact Mass: 302.22458
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Nagashima, F., Kasai, W., Kondoh, M., Fujii, M., Watanabe, Y., Braggins, J.E., Asakawa, Y. Chem Pharm Bull (2003) 51, 1189-92
Species:
Notes: Family : Terpenoids, Type : Diterpenoids, Group : Miscellanea; 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 (CH) | 77.9 |
| 2 (CH2) | 28.9 |
| 3 (CH2) | 40.4 |
| 4 (C) | 33.2 |
| 5 (CH) | 51.4 |
| 6 (CH2) | 18.8 |
| 7 (CH2) | 32.4 |
| 8 (C) | 128.7 |
| 9 (C) | 140.2 |
| 10 (C) | 44.6 |
| 11 (CH) | 39.3 |
| 12 (CH2) | 32.7 |
| 13 (CH) | 39 |
| 14 (CH2) | 44.7 |
| 15 (CH) | 80.4 |
| 16 (C) | 159.6 |
| 17 (CH2) | 107.1 |
| 18 (CH3) | 33.3 |
| 19 (CH3) | 21.9 |
| 20 (CH3) | 15.2 |
