Spektraris NMR
α-Santal-11-ene-10-one
Common Name: α-Santal-11-ene-10-one
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C15H22O/c1-9(2)13(16)5-6-14(3)10-7-11-12(8-10)15(11,14)4/h10-12H,1,5-8H2,2-4H3/t10-,11+,12?,14-,15?/m0/s1
InChIKey: InChIKey=MDRVDKWRYQTZJE-HPFPLBLASA-N
Formula: C15H22O1
Molecular Weight: 218.33514
Exact Mass: 218.167065
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) | 27.3 |
| 2 (CH) | 19.6 |
| 3 (CH2) | 31.5 |
| 4 (CH) | 38.2 |
| 5 (CH2) | 31 |
| 6 (CH) | 19.5 |
| 7 (C) | 45.7 |
| 8 (CH2) | 29.3 |
| 9 (CH2) | 33.2 |
| 10 (C) | 202.9 |
| 11 (C) | 144.5 |
| 12 (CH2) | 124.2 |
| 13 (CH3) | 17.8 |
| 14 (CH3) | 17.4 |
| 15 (CH3) | 10.6 |
Copyright © 2025
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.