Spektraris NMR
Nephtene
Common Name: Nephtene
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C15H24/c1-10(2)13-8-6-12(4)14-7-5-11(3)9-15(13)14/h9-10,12-14H,3,5-8H2,1-2,4H3/t12?,13-,14+/m1/s1
InChIKey: InChIKey=RNDFUOKDULDZPR-IUZLNWEFSA-N
Formula: C15H24
Molecular Weight: 204.351617
Exact Mass: 204.187801
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Kitagawa, I., Culi, Z., Son, B.W., Kobayashi, M., Kyogoku, Y. Chem Pharm Bull (1987) 35, 124
Species:
Notes: Family : Terpenoids, Type : Sesquiterpenoids, Group : Bulgaranes; 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) | 51.3 |
| 2 (CH2) | 29.7 |
| 3 (CH2) | 29.5 |
| 4 (C) | 144 |
| 5 (CH) | 126.8 |
| 6 (C) | 144.2 |
| 7 (CH) | 37.2 |
| 8 (CH2) | 22.9 |
| 9 (CH2) | 27.3 |
| 10 (CH) | 27.4 |
| 11 (CH) | 34.7 |
| 12 (CH3) | 21.3 |
| 13 (CH3) | 21.8 |
| 14 (CH2) | 108.1 |
| 15 (CH3) | 14.8 |
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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.