CARYOPHYLLENE;(1R,9S,4E)-4,11,11-TRIMETHYL-8-METHYLIDENE-BICYCLO-[7.2.0]-UNDEC-4-ENE;CONFORMER-22A
Compound with spectra: 6 NMR, 3 FTIR, and 6 MS (GC)
![CARYOPHYLLENE;(1R,9S,4E)-4,11,11-TRIMETHYL-8-METHYLIDENE-BICYCLO-[7.2.0]-UNDEC-4-ENE;CONFORMER-22A](/api/compound/4DpQUBkCqef.png?ph=true&h=300&w=458 "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 | Database Compilation Copyright © 2023-2025 John Wiley and Sons, Inc. Copyright © 2023-2025 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved. |
|---|---|
| Source of Spectrum | Prof. L. Mondello (Chromaleont s.r.l./Univ. Messina, Italy) |
| Copyright | Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
|---|---|
| Source of Spectrum | PR-582-0-0 |
| Copyright | Copyright © 2020-2025 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 © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
|---|---|
| Source of Spectrum | CBD-17-SM8-3 |
| Copyright | Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
|---|---|
| Source of Spectrum | HRC-20-307-14 (DOI: 10.1002/jhrc.1240200602) |
| Copyright | Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
|---|---|
| Source of Spectrum | X3-35-424-2 |
| Copyright | Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
|---|---|
| Solvent | CDCl3 |
| Copyright | Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
|---|---|
| Solvent | CDCl3 |
| Copyright | Copyright © 2021-2025 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021-2025 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 © 2021-2025 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021-2025 John Wiley & Sons, Inc. All Rights Reserved. |
|---|---|
| Source of Sample | Sigma-Aldrich Co. LLC. |
| Source of Spectrum | Sigma-Aldrich Co. LLC. |
| Catalog Number | 437034 |
| Solvent | CDCl3 |
| Copyright | Copyright © 2018-2025 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2018-2025 John Wiley & Sons, Inc. All Rights Reserved. |
|---|---|
| Source of Sample | Aldrich |
| Catalog Number | W225207 |
| Copyright | Copyright © 2021-2025 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021-2025 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 © 2018-2025 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2018-2025 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 © 2021-2025 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021-2025 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 © 2021-2025 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021-2025 John Wiley & Sons, Inc. All Rights Reserved. |
|---|---|
| Source of Sample | Sigma-Aldrich Co. LLC. |
| Source of Spectrum | Sigma-Aldrich Co. LLC. |
| Catalog Number | 437034 |
| 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
- beta-Caryophyllene
- (-)-trans-Caryophyllene
- (-)-Isocaryophyllene
- 4,11,11-Trimethyl-8-methylenebicyclo(7.2.0)undec-4-ene
- E-Caryophyllene
- Z-Caryophyllene
- Caryophyllene(E-)
- Bicyclo(7.2.0)undec-4-ene, 4,11,11-trimethyl-8-methylene-
- trans-(1R,9S)-8-Methylene-4,11,11-trimethylbicyclo[7.2.0]undec-4-ene
- (1R,4Z,9S)-4,11,11-trimethyl-8-methylidene-bicyclo[7.2.0]undec-4-ene
- (1R,9S)-4,11,11-trimethyl-8-methylenebicyclo[7.2.0]undec-4-ene
- .gamma.-caryophyllene
- (1R,9S,Z)-4,11,11-trimethyl-8-methylenebicyclo[7.2.0]undec-4-ene
(1R,2S)-1-[(4-Acetoxy-3-oxo)butyl]-4,4-dimethyl-2-(4-formylbut-1-en-2-yl)cyclobutane
METHYL-4-OXO-4,5-SECO-CARYPHYLLEN-5-OATE
4-[(1S,2R)-3,3-dimethyl-2-(3-oxidanylidenebutyl)cyclobutyl]-N'-oxidanyl-pent-4-enimidamide
Bicyclo[7.2.0]undecane, 10,10-dimethyl-2,6-bis(methylene)-, [1S-(1R*,9S*)]-
(1S,8R)-5-Ethyl-9,9-dimethyl-2-methylenebicyclo[6.2.0]decane
CARYOPHYLLA-8(14)-EN-5-ONE
2,2,4-Trimethyl-3-(3,8,12,16-tetramethyl-heptadeca-3,7,11,15-tetraenyl)-cyclohexanol
XQTRKAALUUGASH-OSQFROBYSA-N
(Z)-(R)-2-Methyl-6-((1S,5S)-4-methylene-bicyclo[3.1.0]hex-1-yl)-hept-2-en-1-ol
ISOLITSEANE_A;3-BETA-HYDROXYMETHYL-2-ALPHA-METHYL-4-ALPHA-(5-METHYL-1-METHYLENEHEX-4-ENYL)-CYCLOPENTANONE
| Title | Journal or Book | Year |
|---|---|---|
| Xenicane Diterpenes Revisited: Thermal (E)?(Z) isomerization and conformational motions. A unifying picture | Helvetica Chimica Acta | 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.