Spektraris NMR

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

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

CAS Registry Number:

InChI: InChI=1S/C15H22O2/c1-8-4-5-10-14(15(10,3)7-16)13-9(2)6-11(17)12(8)13/h9-10,13-14,16H,4-7H2,1-3H3/t9-,10-,13-,14-,15+/m1/s1

InChIKey: InChIKey=XJNJKJKMYNGWRW-ZXMBVREDSA-N

Formula: C15H22O2

Molecular Weight: 234.334545

Exact Mass: 234.16198

NMR Solvent: CDCl3

MHz:

Calibration:

NMR references: 13C - Staerk, D., Skole, B., Jorgensen, F.S., Budnik, B.A., Ekpe, P., Jaroszewski, J.W. J Nat Prod (2004) 67, 799-805

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)