Spektraris NMR
11-Hydroperoxy-α-santal-9-ene
Common Name: 11-Hydroperoxy-α-santal-9-ene
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C15H24O2/c1-13(2,17-16)6-5-7-14(3)10-8-11-12(9-10)15(11,14)4/h5-6,10-12,16H,7-9H2,1-4H3/b6-5+/t10-,11+,12?,14-,15?/m0/s1
InChIKey: InChIKey=GGZBQFCHIVQVGC-LPWQABPRSA-N
Formula: C15H24O2
Molecular Weight: 236.350426
Exact Mass: 236.17763
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Ngo, K.S., Brown, G.D. Phytochemistry (1999) 50, 1213-8
Species:
Notes: Family : Terpenoids, Type : Sesquiterpenoids, Group : Santalanes; 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 (C) | 27 |
| 2 (CH) | 19.7 |
| 3 (CH2) | 31.3 |
| 4 (CH) | 38.6 |
| 5 (CH2) | 31 |
| 6 (CH) | 19.6 |
| 7 (C) | 46.3 |
| 8 (CH2) | 37.4 |
| 9 (CH) | 129.3 |
| 10 (CH) | 134.6 |
| 11 (C) | 82.3 |
| 12 (CH3) | 24.38 |
| 13 (CH3) | 24.43 |
| 14 (CH3) | 17.5 |
| 15 (CH3) | 10.7 |
