Spektraris NMR
Nephthediol
Common Name: Nephthediol
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C14H24O3/c1-9(2)12-6-4-10(3)13(16)7-5-11(15)8-14(12)17/h9,11-13,15-16H,3-8H2,1-2H3
InChIKey: InChIKey=HSTUJTMDFYTISV-UHFFFAOYSA-N
Formula: C14H24O3
Molecular Weight: 240.339095
Exact Mass: 240.172545
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Yang, R.L., Kuang, Y.Y., Su, J.Y., Zeng, L.M. Nat Prod Res (2008) 22, 1605-9
Species:
Notes: Family : Terpenoids, Type : Sesquiterpenoids, Group : Germacranes; 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) | 40.1 |
| 2 (CH2) | 28.1 |
| 3 (CH) | 79.3 |
| 4 (C) | 151.9 |
| 5 (CH2) | 32.6 |
| 6 (CH2) | 23.9 |
| 7 (CH) | 49.9 |
| 8 (C) | 210.3 |
| 9 (CH2) | 48.6 |
| 10 (CH) | 75.1 |
| 11 (CH) | 27.7 |
| 12 (CH3) | 17.1 |
| 13 (CH3) | 21.7 |
| 15 (CH2) | 110 |
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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.