Spektraris NMR
Centdarol
Common Name: Centdarol
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C15H26O2/c1-10-6-7-11-12(13(10)16)14(2,3)8-5-9-15(11,4)17/h6,11-13,16-17H,5,7-9H2,1-4H3/t11-,12-,13+,15-/m1/s1
InChIKey: InChIKey=NUXLUAXOQWMFEE-GUIRCDHDSA-N
Formula: C15H26O2
Molecular Weight: 238.366308
Exact Mass: 238.19328
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Ngo, K.S., Brown, G.D. Tetrahedron (1999) 55, 759-70
Species:
Notes: Family : Terpenoids, Type : Sesquiterpenoids, Group : Himachalanes; 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) | 45.8 |
| 2 (C) | 74.2 |
| 3 (CH2) | 41.5 |
| 4 (CH2) | 18.3 |
| 5 (CH2) | 44.8 |
| 6 (C) | 35.8 |
| 7 (CH) | 45.3 |
| 8 (CH) | 72.1 |
| 9 (C) | 135.2 |
| 10 (CH) | 127.3 |
| 11 (CH2) | 26.5 |
| 12 (CH3) | 31.9 |
| 13 (CH3) | 32.2 |
| 14 (CH3) | 28.7 |
| 15 (CH3) | 21.1 |
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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.