Spektraris NMR

Common Name: (2S,3R,4S,5R)-1beta-Isopropyl-4-methylbicyclo[3.1.0]hexane-2alpha,3beta,4beta-triol

Synonyms: (2S,3R,4S,5R)-1beta-Isopropyl-4-methylbicyclo[3.1.0]hexane-2alpha,3beta,4beta-triol

CAS Registry Number:

InChI: InChI=1S/C10H18O3/c1-5(2)10-4-6(10)9(3,13)7(11)8(10)12/h5-8,11-13H,4H2,1-3H3/t6-,7+,8+,9-,10+/m0/s1

InChIKey: InChIKey=DDMXBVSMDXJGPL-LOLPMWEVSA-N

Formula: C10H18O3

Molecular Weight: 186.248507

Exact Mass: 186.125594

NMR Solvent: CDCl3

MHz:

Calibration:

NMR references: 13C - Ahmed, A.A., El-Moghazy, S.A., El-Shanawany, M.A., Abdel-Ghani, H.F., Karchesy, J., Sturtz, G., Dalley, K., Pare, P.W. J Nat Prod (2004) 67, 1705-10

Species:

Notes: Family : Terpenoids, Type : Monoterpenoids, Group : p-Menthanes; 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)