Spektraris NMR
ar-Bisabol-9-en-7,11-diol
Common Name: ar-Bisabol-9-en-7,11-diol
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C15H22O2/c1-12-6-8-13(9-7-12)15(4,17)11-5-10-14(2,3)16/h5-10,16-17H,11H2,1-4H3/b10-5+
InChIKey: InChIKey=SPZUMECVMNZCHK-BJMVGYQFSA-N
Formula: C15H22O2
Molecular Weight: 234.334545
Exact Mass: 234.16198
NMR Solvent: CD3COCD3
MHz:
Calibration:
NMR references: 13C - Sun, J., Shi, D., Ma, M., Li, S., Wang, S., Han, L., Yang, Y., Fan, X., Shi, J., He, L. J Nat Prod (2005) 68, 915-9
Species:
Notes: Family : Terpenoids, Type : Sesquiterpenoids, Group : Bisabolanes; 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) | 125.8 |
| 2 (CH) | 129.1 |
| 3 (C) | 135.9 |
| 4 (CH) | 129.1 |
| 5 (CH) | 125.8 |
| 6 (C) | 147 |
| 7 (C) | 73.9 |
| 8 (CH2) | 48.2 |
| 9 (CH) | 122.5 |
| 10 (CH) | 143.2 |
| 11 (C) | 70.1 |
| 12 (CH3) | 30.4 |
| 13 (CH3) | 30.4 |
| 14 (CH3) | 29.6 |
| 15 (CH3) | 20.9 |
