For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
MONTBRETOL
SpectraBase Compound ID BmlTnLmg2Cp
InChI InChI=1S/C20H26O3/c1-11(2)12-9-13-14(10-15(12)21)20(5)8-6-7-19(3,4)18(20)17(23)16(13)22/h9-11,21,23H,6-8H2,1-5H3/t20-/m1/s1
InChIKey XLUHSPYVUOVWRM-HXUWFJFHSA-N
Mol Weight 314.43 g/mol
Molecular Formula C20H26O3
Exact Mass 314.188195 g/mol
Enantiomer InChIKey XLUHSPYVUOVWRM-FQEVSTJZSA-N
Racemate InChIKey XLUHSPYVUOVWRM-UHFFFAOYSA-N
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Source of Spectrum X2-55-443-1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent CDCl3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent CDCl3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent CDCl3
  • XLUHSPYVUOVWRM-HXUWFJFHSA-N
  • 6,12-DIHYDROXYABIETA-5,8,11,13-TETRAEN-7-ONE
  • (4aR)-1,1,4a-trimethyl-6,10-bis(oxidanyl)-7-propan-2-yl-3,4-dihydro-2H-phenanthren-9-one
Title Journal or Book Year
13C NMR Data for abieta-8,11,13-triene diterpenoids Magnetic Resonance in Chemistry 1994
Abietanes and kauranes from leaves of Cryptomeria japonica Phytochemistry 1994
New Abietane Diterpenoids from Salvia montbretii Journal of Natural Products 1992

This compound is available in the following databases:

KnowItAll NMR Spectral Library

Author: Wiley

The KnowItAll NMR Spectral Library offers a comprehensive collection of NMR reference spectra, including NMR, CNMR, and XNMR, and covers a wide range of compounds including organics, polymers, monomers, metabolites, and more. Learn more.

KnowItAll Mass Spectral Library

Author: Wiley

The KnowItAll Mass Spectral Library offers a comprehensive collection of mass spectra, including the renowned Wiley Registry, and access to a wide range of compounds including pure organics, drugs, steroids, additives, geochemicals, petrochemicals, biomarkers, and more. Learn more.

Unknown Identification

Search your unknown spectrum against the world's largest collection of reference spectra

KnowItAll Campus Solutions

KnowItAll offers faculty and students at your school access to all the tools you need for spectral analysis and structure drawing & publishing! Plus, access the world's largest spectral library.