Spektraris NMR
seco-Hinokiol
Common Name: seco-Hinokiol
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C20H28O3/c1-12(2)15-10-14-6-7-16(13(3)4)20(5,9-8-19(22)23)17(14)11-18(15)21/h10-12,16,21H,3,6-9H2,1-2,4-5H3,(H,22,23)/t16-,20-/m0/s1
InChIKey: InChIKey=QMBUAKNMOKTEHM-JXFKEZNVSA-N
Formula: C20H28O3
Molecular Weight: 316.435274
Exact Mass: 316.203845
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Cantrell, C.L., Richheimer, S.L., Nicholas, G.M., Schmidt, B.K., Bailey, D.T. J Nat Prod (2005) 68, 98-100
Species:
Notes: Family : Terpenoids, Type : Diterpenoids, Group : Abietanes; 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 (CH2) | 34.8 |
| 2 (CH2) | 28.6 |
| 3 (C) | 174.3 |
| 4 (C) | 147.2 |
| 5 (CH) | 47 |
| 6 (CH2) | 25.1 |
| 7 (CH2) | 29 |
| 8 (C) | 127.7 |
| 9 (C) | 141.1 |
| 10 (C) | 40.4 |
| 11 (CH) | 112.4 |
| 12 (C) | 152.8 |
| 13 (C) | 133.4 |
| 14 (CH) | 126.5 |
| 15 (CH) | 26.7 |
| 16 (CH3) | 22 |
| 17 (CH3) | 22.2 |
| 18 (CH2) | 113.7 |
| 19 (CH3) | 22.4 |
| 20 (CH3) | 27.6 |
