Spektraris NMR
Norecasantalic acid
Common Name: Norecasantalic acid
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C11H16O2/c1-10(5-9(12)13)6-3-7-8(4-6)11(7,10)2/h6-8H,3-5H2,1-2H3,(H,12,13)/t6-,7+,8?,10-,11?/m0/s1
InChIKey: InChIKey=LDSSHHGVKDZTIX-LAOSEHSUSA-N
Formula: C11H16O2
Molecular Weight: 180.243957
Exact Mass: 180.11503
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) | 27.1 |
| 2 (CH) | 19.3 |
| 3 (CH2) | 31.6 |
| 4 (CH) | 39 |
| 5 (CH2) | 31.3 |
| 6 (CH) | 19.4 |
| 7 (C) | 45.7 |
| 8 (CH2) | 38.8 |
| 9 (C) | 177.8 |
| 14 (CH3) | 17.8 |
| 15 (CH3) | 10.5 |
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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.