Lemnal-1(10)-ene-2,12-dione

Lemnal-1(10)-ene-2,12-dione

Common Name: Lemnal-1(10)-ene-2,12-dione

Synonyms:

CAS Registry Number:

InChI: InChI=1S/C15H20O3/c1-8-6-11(16)7-10-4-5-12-13(15(8,10)3)9(2)14(17)18-12/h7-9,12-13H,4-6H2,1-3H3/t8-,9-,12-,13-,15+/m0/s1

InChIKey: InChIKey=FDXWIBXGNSYWLQ-GLBWXDBNSA-N

Formula: C15H20O3

Molecular Weight: 248.318068

Exact Mass: 248.141245

NMR Solvent: CDCl3

MHz:

Calibration:

NMR references: 13C - El-Gamal, A.A., Wang, S.K., Dai, C.F., Duh, C.Y. J Nat Prod (2004) 67, 1455-8

Species:

Notes: Family : Terpenoids, Type : Sesquiterpenoids, Group : Nardosinanes; 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 (CH) 128
2 (C) 197.8
3 (CH2) 41.6
4 (CH) 35.6
5 (C) 42.3
6 (CH) 49.4
7 (CH) 75
8 (CH2) 27.2
9 (CH2) 27.9
10 (C) 165.1
11 (CH) 36.9
12 (C) 179.8
13 (CH3) 18
14 (CH3) 19
15 (CH3) 15.5