5a,6b,7b,11b-H,1??10),3-Guaiadien-12,6-olide

5a,6b,7b,11b-H,1??10),3-Guaiadien-12,6-olide

Common Name: 5a,6b,7b,11b-H,1??10),3-Guaiadien-12,6-olide

Synonyms:

CAS Registry Number:

InChI: InChI=1S/C15H20O2/c1-8-4-7-12-10(3)15(16)17-14(12)13-9(2)5-6-11(8)13/h5,10,12-14H,4,6-7H2,1-3H3/t10-,12-,13-,14-/m0/s1

InChIKey: InChIKey=WBHVRMWEPJHOHP-PYJNHQTQSA-N

Formula: C15H20O2

Molecular Weight: 232.318663

Exact Mass: 232.14633

NMR Solvent: CDCl3

MHz:

Calibration:

NMR references: 13C - Li, Y.S., Chen, J.J., Zhou, H., Luo, S.D., Wang, H.Y., Zhu, D.Y. Planta Med (2003) 69, 962-4

Species:

Notes: Family : Terpenoids, Type : Sesquiterpenoids, Group : Guaianes; 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) 130.9
2 (CH2) 37.9
3 (CH) 124
4 (C) 141.9
5 (CH) 50.6
6 (CH) 86
7 (CH) 38.4
8 (CH2) 18.8
9 (CH2) 36.2
10 (C) 127.4
11 (CH) 42
12 (C) 179.1
13 (CH3) 10.2
14 (CH3) 21.2
15 (CH3) 16.6