Spektraris NMR
Hedaol A
Common Name: Hedaol A
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C18H30O2/c1-14(2)12-18(20)13-16(4)10-6-8-15(3)9-7-11-17(5)19/h9,12-13,17,19H,6-8,10-11H2,1-5H3/b15-9+,16-13-/t17-/m1/s1
InChIKey: InChIKey=TZNBCSGCHOVZDX-ZDROHQCRSA-N
Formula: C18H30O2
Molecular Weight: 278.430279
Exact Mass: 278.22458
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Takada, N., Watanabe, R., Suenaga, K., Yamada, K., Uemura, D. J Nat Prod (2001) 64, 653-5
Species:
Notes: Family : Terpenoids, Type : Diterpenoids, Group : Phytanes; 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 (CH3) | 26 |
| 2 (C) | 154 |
| 3 (CH) | 127.1 |
| 4 (C) | 191 |
| 5 (CH) | 127.1 |
| 6 (C) | 158.2 |
| 7 (CH2) | 33.4 |
| 8 (CH2) | 26.8 |
| 9 (CH2) | 40.3 |
| 10 (C) | 135 |
| 11 (CH) | 125.2 |
| 12 (CH2) | 24.8 |
| 13 (CH2) | 39.7 |
| 14 (CH) | 68.3 |
| 15 (CH3) | 23.6 |
| 16 (CH3) | 20.9 |
| 17 (CH3) | 28.2 |
| 18 (CH3) | 16 |
