Spektraris NMR
2(E),4-Ochtodien-1,6(R*)-diol
Common Name: 2(E),4-Ochtodien-1,6(R*)-diol
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C10H16O2/c1-10(2)7-8(5-6-11)3-4-9(10)12/h3-5,9,11-12H,6-7H2,1-2H3/b8-5-/t9-/m0/s1
InChIKey: InChIKey=OZMPRKSGMPJXGO-RDOCRHDPSA-N
Formula: C10H16O2
Molecular Weight: 168.233221
Exact Mass: 168.11503
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Paul, V.J., McConnell, O.J., Fenical, W. J Org Chem (1980) 45, 3401-7
Species:
Notes: Family : Terpenoids, Type : Monoterpenoids, Group : Ochtodanes; 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) | 58.6 |
| 2 (CH) | 131.2 |
| 3 (C) | 135.7 |
| 4 (CH) | 128.2 |
| 5 (CH) | 130.2 |
| 6 (CH) | 74.1 |
| 7 (C) | 34.7 |
| 8 (CH2) | 36.3 |
| 9 (CH3) | 26.7 |
| 10 (CH3) | 21.3 |
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The Spektraris NMR database is developed and hosted by the Lange laboratory at WSU. CAS Registry Number is a Registered Trademark of the American Chemical Society.