John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=4DpQUBkCqef

(accessed ).
CARYOPHYLLENE;(1R,9S,4E)-4,11,11-TRIMETHYL-8-METHYLIDENE-BICYCLO-[7.2.0]-UNDEC-4-ENE;CONFORMER-22A
SpectraBase Compound ID 4DpQUBkCqef
InChI InChI=1S/C15H24/c1-11-6-5-7-12(2)13-10-15(3,4)14(13)9-8-11/h6,13-14H,2,5,7-10H2,1,3-4H3/b11-6-/t13-,14-/m1/s1
InChIKey NPNUFJAVOOONJE-FLFDDASRSA-N
Mol Weight 204.36 g/mol
Molecular Formula C15H24
Exact Mass 204.187801 g/mol
Enantiomer InChIKey NPNUFJAVOOONJE-BJLYVFBQSA-N
Copyright Copyright © 2020-2021 John Wiley & Sons, Inc. All Rights Reserved.
Source of Spectrum PR-582-0-0
Copyright Copyright © 2020-2021 John Wiley & Sons, Inc. All Rights Reserved.
Source of Spectrum Annick D. Bossoua, et al. Industrial Crops and Products, V.76, 2015, P.306-317
Copyright Copyright © 2020-2021 John Wiley & Sons, Inc. All Rights Reserved.
Source of Spectrum X3-35-424-2
Copyright Copyright © 2016-2021 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent CDCl3
Copyright Copyright © 2016-2021 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent CDCl3
Copyright Copyright © 2021 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved.
Source of Sample Sigma-Aldrich Co. LLC.
Source of Spectrum Sigma-Aldrich Co. LLC.
Catalog Number W225207
Solvent CDCl3
Copyright Copyright © 2018-2021 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2018-2021 John Wiley & Sons, Inc. All Rights Reserved.
Source of Sample Aldrich
Catalog Number W225207
Copyright Copyright © 2021 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved.
Source of Sample Sigma-Aldrich Co. LLC.
Source of Spectrum Sigma-Aldrich Co. LLC.
Catalog Number W225207
Technique Between salts
Copyright Copyright © 2018-2021 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2018-2021 John Wiley & Sons, Inc. All Rights Reserved.
Source of Sample Aldrich
Source of Spectrum Sigma-Aldrich Co. LLC.
Catalog Number W225207
Technique Neat
Copyright Copyright © 2021 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved.
Source of Sample Sigma-Aldrich Co. LLC.
Source of Spectrum Sigma-Aldrich Co. LLC.
Catalog Number W225207
Solvent CDCl3
  • CARYOPHYLLENE;(1R,9S,4E)-4,11,11-TRIMETHYL-8-METHYLIDENE-BICYCLO-[7.2.0]-UNDEC-4-ENE;CONFORMER-22B
  • (1R,4Z,9S)-4,11,11-trimethyl-8-methylene-bicyclo[7.2.0]undec-4-ene
  • E-Caryophyllene
  • beta-Caryophyllene
  • (-)-trans-Caryophyllene
  • trans-(1R,9S)-8-Methylene-4,11,11-trimethylbicyclo[7.2.0]undec-4-ene
Title Journal or Book Year
Xenicane Diterpenes Revisited: Thermal (E)?(Z) isomerization and conformational motions. A unifying picture Helvetica Chimica Acta 1994
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.