Spektraris NMR

Common Name: (1aR)-1,1abeta,2,5,6,7,7aalpha,7bbeta-Octahydro-1,4,7beta-trimethyl-1alpha-(hydroxymethyl)-5beta-hydroxy-3H-cyclopropa[e]azulene-3-one

Synonyms: (1aR)-1,1abeta,2,5,6,7,7aalpha,7bbeta-Octahydro-1,4,7beta-trimethyl-1alpha-(hydroxymethyl)-5beta-hydroxy-3H-cyclopropa[e]azulene-3-one

CAS Registry Number:

InChI: InChI=1S/C15H22O3/c1-7-4-11(18)13-8(2)10(17)5-9-14(12(7)13)15(9,3)6-16/h7,9,11-12,14,16,18H,4-6H2,1-3H3/t7-,9-,11+,12-,14-,15-/m1/s1

InChIKey: InChIKey=YIEFDGFNXNISQJ-PNVNJHFYSA-N

Formula: C15H22O3

Molecular Weight: 250.33395

Exact Mass: 250.156895

NMR Solvent: CDCl3

MHz:

Calibration:

NMR references: 13C - Collins, D.O., Ruddock, P.L., Chiverton de Grasse, J., Reynolds, W.F., Reese, P.B. Phytochemistry (2002) 59, 479-88

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)