Common Name:
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C18H28O6/c1-9-7-11(23-10(2)19)13-16(3,4)8-17(5)15(20)24-14(22-6)12(9)18(13,17)21/h9,11-14,21H,7-8H2,1-6H3/t9-,11+,12-,13+,14-,17-,18-/m1/s1
InChIKey: InChIKey=GOGNSPHNRCZEML-RIVVHQBZSA-N
Formula: C18H28O6
Molecular Weight: 340.412017
Exact Mass: 340.188589
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Collado, I.G., Aleu, J., Hernandez-Galan, R., Duran-Patron, R., Curr Org Chem (2000) 4, 1261-86
Species:
Notes: Family : Terpenoids, Type : Sesquiterpenoids, Group : Botryanes; 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)
Position | PPM |
---|---|
1 (CH) | 53.2 |
2 (CH) | 31.2 |
3 (CH2) | 39 |
4 (CH) | 72.2 |
5 (CH) | 61.4 |
6 (C) | 39.2 |
7 (CH2) | 50.1 |
8 (C) | 54.2 |
9 (C) | 87.2 |
10 (CH) | 103.6 |
11 (CH3) | 21.3 |
12 (CH3) | 36.2 |
13 (CH3) | 27.3 |
14 (CH3) | 29.3 |
15 (C) | 174.3 |
4a (C) | 20.6 |
4b (CH3) | 172 |
10a (CH3) | 57.3 |