Spektraris NMR
Ambrox-1,6-diol
Common Name: Ambrox-1,6-diol
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C16H28O3/c1-14(2)7-5-12(18)16(4)11-6-8-19-15(11,3)9-10(17)13(14)16/h10-13,17-18H,5-9H2,1-4H3/t10-,11-,12-,13-,15+,16-/m0/s1
InChIKey: InChIKey=RHUCHGBHUNBWKC-QNSZCRRISA-N
Formula: C16H28O3
Molecular Weight: 268.39233
Exact Mass: 268.203845
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Choudhary, M.I., Musharraf, S.G., Sami, A., Atta ur, R. Helv Chim Acta (2004) 87, 2685-94
Species:
Notes: Family : Terpenoids, Type : Sesquiterpenoids, Group : Drimanes; 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) | 74.7 |
| 2 (CH2) | 25.1 |
| 3 (CH2) | 38.8 |
| 4 (C) | 35.3 |
| 5 (CH) | 52.1 |
| 6 (CH) | 71.1 |
| 7 (CH2) | 48.5 |
| 8 (C) | 80.9 |
| 9 (CH) | 54 |
| 10 (C) | 41.5 |
| 11 (CH2) | 27.1 |
| 12 (CH2) | 65.8 |
| 13 (CH3) | 23.9 |
| 14 (CH3) | 25.1 |
| 15 (CH3) | 23.6 |
| 16 (CH3) | 18.4 |
