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

*Links on SpectraBase are not permalinks.

7-ALPHA-HYDROXYMETHYL-ISOMER

Compound with spectra: 1 NMR, and 1 MS (GC)

7-ALPHA-HYDROXYMETHYL-ISOMER
SpectraBase Compound ID 9gyKmkIL6eV
InChI InChI=1S/C22H32O3/c1-14(2)15-8-9-17-16(12-15)18(24-5)13-19-21(17,3)10-7-11-22(19,4)20(23)25-6/h8-9,12,14,18-19H,7,10-11,13H2,1-6H3/t18-,19?,21-,22-/m1/s1
InChIKey CDJVFESJEAWQGP-BAWFOZSCSA-N
Mol Weight 344.5 g/mol
Molecular Formula C22H32O3
Exact Mass 344.235145 g/mol
Enantiomer InChIKey CDJVFESJEAWQGP-HQHXSWNVSA-N

View Spectrum of 7-ALPHA-HYDROXYMETHYL-ISOMER

MS (GC) Spectrum
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Source of Spectrum OP-25-220-8

View Spectrum of 7-ALPHA-HYDROXYMETHYL-ISOMER

13C NMR Spectrum
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent CDCl3
  • Methyl 7-.alpha.-methoxy-dehydroabietate
Methyl 9-methoxy-1,2,3,4,4a,9,10,10a-octahydro-1,4a-dimethyl-7-(1'-methylethyl)phenanthrene-1-carboxyltate
7A-METHOXY-8,11,13-TRIENE-18-DEHYDROABIETIC ACID METHYL ESTER
7B-METHOXY-8,11,13-TRIENE-18-DEHYDROABIETIC ACID METHYL ESTER
7-BETA-HYDROXYMETHYL-ISOMER
9-Acetoxy-7-isopropyl-1,4a-dimethyl-2,3,4,9,10,10a-hexahydrophenanthrene-1-carboxylic acid methyl ester
7-ALPHA-METHOXY-DEHYDROABIETIC-ACID
Methyl 7-hydroxyabieta-9(11),8(14),12-trien-18-oate
7B-HYDROXY-8,11,13-TRIENE-18-DEHYDROABIETIC ACID METHYL ESTER
7-ALPHA-ISOMER
[1S-(1.alpha.,4a.alpha.,9.beta.,10a.beta.)] - 1,2,3,4,4a,9,10,10a - octahydro - 9 - hydroxy - 1,4a - dimethyl - 7 - (1-methylethyl) - 1 - phenanthrene - carboxylic acid, methyl ester
Title Journal or Book Year
13C NMR Data for abieta-8,11,13-triene diterpenoids Magnetic Resonance in Chemistry 1994

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.

Other Resources
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.