1,1aalpha,2,3,4,7,7a,7balpha-Octahydro-7aalpha-hydroxy-1,1,4alpha,7alpha-tetramethyl-6H-cycloprop[e]azulen-6-one

1,1aalpha,2,3,4,7,7a,7balpha-Octahydro-7aalpha-hydroxy-1,1,4alpha,7alpha-tetramethyl-6H-cycloprop[e]azulen-6-one

Common Name: 1,1aalpha,2,3,4,7,7a,7balpha-Octahydro-7aalpha-hydroxy-1,1,4alpha,7alpha-tetramethyl-6H-cycloprop[e]azulen-6-one

Synonyms: 1,1aalpha,2,3,4,7,7a,7balpha-Octahydro-7aalpha-hydroxy-1,1,4alpha,7alpha-tetramethyl-6H-cycloprop[e]azulen-6-one

CAS Registry Number:

InChI: InChI=1S/C15H22O2/c1-8-5-6-10-13(14(10,3)4)15(17)9(2)12(16)7-11(8)15/h7-10,13,17H,5-6H2,1-4H3/t8-,9-,10-,13+,15-/m0/s1

InChIKey: InChIKey=HKHLLRWQSNCOHC-BLHPFNGSSA-N

Formula: C15H22O2

Molecular Weight: 234.334545

Exact Mass: 234.16198

NMR Solvent: C6D6

MHz:

Calibration:

NMR references: 13C - Toyota, M., Nakamura, I., Takaoka, S., Kan, Y., Asakawa, Y. Phytochemistry (1996) 41, 575-80

Species:

Notes: Family : Terpenoids, Type : Sesquiterpenoids, Group : Aromadendranes; 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) 184.4
2 (CH) 132.3
3 (C) 209.3
4 (CH) 53.8
5 (C) 83.1
6 (CH) 36.5
7 (CH) 27.7
8 (CH2) 22.3
9 (CH2) 32.2
10 (CH) 40.1
11 (C) 18.8
12 (CH3) 15.1
13 (CH3) 30.2
14 (CH3) 25.6
15 (CH3) 11.1