(4S)-4-Isopropyl-6-methyl-7-hydroxy-1,2,3,4-tetrahydronaphthalene-1-one

(4S)-4-Isopropyl-6-methyl-7-hydroxy-1,2,3,4-tetrahydronaphthalene-1-one

Common Name: (4S)-4-Isopropyl-6-methyl-7-hydroxy-1,2,3,4-tetrahydronaphthalene-1-one

Synonyms: (4S)-4-Isopropyl-6-methyl-7-hydroxy-1,2,3,4-tetrahydronaphthalene-1-one

CAS Registry Number:

InChI: InChI=1S/C14H18O2/c1-8(2)10-4-5-13(15)12-7-14(16)9(3)6-11(10)12/h6-8,10,16H,4-5H2,1-3H3/t10-/m0/s1

InChIKey: InChIKey=WAYDMOHRARCCDD-JTQLQIEISA-N

Formula: C14H18O2

Molecular Weight: 218.292046

Exact Mass: 218.13068

NMR Solvent: CDCl3

MHz:

Calibration:

NMR references: 13C - Morimoto, M., Cantrell, C.L., Libous-Bailey, L., Duke, S.O. Phytochemistry (2009) 70, 69-74

Species:

Notes: Family : Terpenoids, Type : Sesquiterpenoids, Group : Calamenenes; 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) 140.3
2 (CH) 112.5
3 (C) 153.4
4 (C) 131.7
5 (CH) 131.6
6 (C) 131.3
7 (CH) 44.1
8 (CH2) 24.6
9 (CH2) 35.5
10 (C) 200
11 (CH) 30.4
12 (CH3) 21.8
13 (CH3) 20
14 (CH3) 16.7