Spektraris NMR
B1-Cadinene
Common Name: B1-Cadinene
Synonyms: B1-Cadinene
CAS Registry Number:
InChI: InChI=1S/C15H24/c1-10(2)13-8-6-12(4)14-7-5-11(3)9-15(13)14/h6,9-10,13-15H,5,7-8H2,1-4H3/t13-,14+,15-/m1/s1
InChIKey: InChIKey=QMAYBMKBYCGXDH-QLFBSQMISA-N
Formula: C15H24
Molecular Weight: 204.351617
Exact Mass: 204.187801
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Ngo, K.S., Wong, W.T., Brown, G.D. J Nat Prod (1999) 62, 549-53
Species:
Notes: Family : Terpenoids, Type : Sesquiterpenoids, Group : Muurolanes; 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) | 38.6 |
| 2 (CH2) | 25.3 |
| 3 (CH2) | 26.5 |
| 4 (C) | 135.9 |
| 5 (CH) | 119.5 |
| 6 (CH) | 36 |
| 7 (CH) | 45 |
| 8 (CH2) | 27.2 |
| 9 (CH) | 123.9 |
| 10 (C) | 133.7 |
| 11 (CH) | 28.8 |
| 12 (CH3) | 20.8 |
| 13 (CH3) | 21.5 |
| 14 (CH3) | 24.1 |
| 15 (CH3) | 20.6 |
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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.