Xanthoxylin
Compound with spectra: 7 NMR, 4 FTIR, 1 Raman, 2 UV-Vis, and 9 MS (GC)
| SpectraBase Compound ID | LqKSVuGAflp |
|---|---|
| InChI | InChI=1S/C10H12O4/c1-6(11)10-8(12)4-7(13-2)5-9(10)14-3/h4-5,12H,1-3H3 |
| InChIKey | FBUBVLUPUDBFME-UHFFFAOYSA-N |
| Mol Weight | 196.2 g/mol |
| Molecular Formula | C10H12O4 |
| Exact Mass | 196.073559 g/mol |
| Copyright | Copyright © 1989, 1990-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
|---|---|
| Technique | KBr-Pellet |
| Copyright | Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved. |
|---|---|
| Source of Sample | Aldrich Chemical Company, Inc., Milwaukee, Wisconsin |
| Technique | KBr WAFER |
| Copyright | Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved. |
|---|---|
| Source of Sample | Aldrich Chemical Company, Inc., Milwaukee, Wisconsin |
| Solvent | Chloroform-d; Reference=TMS Spectrometer= Varian CFT-20 |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
|---|---|
| Solvent | DMSO-D6 |
| 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 | Unknown |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
|---|---|
| Solvent | Unknown |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
|---|---|
| Solvent | Unknown |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
|---|
| Copyright | Copyright © 2017-2024 John Wiley & Sons, Inc. All Rights Reserved. |
|---|---|
| Source of Sample | TCI Chemicals India Pvt. Ltd. |
| Source of Spectrum | Bio-Rad Laboratories, Inc. |
| Catalog Number | D2683 |
| Copyright | Copyright © 2018-2024 John Wiley & Sons, Inc. All Rights Reserved. |
|---|---|
| Source of Sample | TCI Chemicals India Pvt. Ltd. |
| Source of Spectrum | Bio-Rad Laboratories, Inc. |
| Catalog Number | D2683 |
| Copyright | Copyright © 2008-2024 John Wiley & Sons, Inc. All Rights Reserved. |
|---|---|
| Solvent | Methanol |
| Copyright | Copyright © 2008-2024 John Wiley & Sons, Inc. All Rights Reserved. |
|---|---|
| Solvent | Methanol |
| Copyright | Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved. |
|---|
| Copyright | Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved. |
|---|---|
| Source of Spectrum | Adams' Essential Oil Components (GC-MS), Version 4 |
| Copyright | Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 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 © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
|---|---|
| Source of Spectrum | SRH-2022-6343-0 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
|---|---|
| Source of Spectrum | Adams' Essential Oil Components (GC-MS), Version 4 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
|---|---|
| Source of Spectrum | AD-0-2532-0 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
|---|---|
| Source of Spectrum | Y1-44B-1925-2 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
|---|---|
| Source of Spectrum | X2-55-1759-0 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
|---|---|
| Source of Spectrum | SRH-2022-10724-0 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
|---|---|
| Source of Spectrum | QA-51-635-19 |
- 4',6'-Dimethoxy-2'-hydroxyacetophenone
- Brevifolin
- 2',4'-Dimethoxy-6'-hydroxyacetophenone
- 2-Hydroxy-4,6-dimethoxyacetophenone
- 2'-Hydroxy-4',6'-dimethoxyacetophenone
- XANTHOXYLIN;2-HYDROXY-4,6-DIMETHOXY-ACETOPHENONE
- 2,4-DI-O-METHYLPHLORACETOPHENON
- ACETOPHENONE, 2',4'-DIMETHOXY- 6'-HYDROXY-,
- ACETOPHENONE, 2*,4*-DIMETHOXY- 6*-HYDROXY-,
- Acetophenone, 2'-hydroxy-4',6'-dimethoxy-
- Phloroacetophenone 2,4-dimethylether
- Ethanone, 1-(2-hydroxy-4,6-dimethoxyphenyl)-
4,6-dimethoxysalicylic acid
2,4,6-trimethoxy-N-methylbenzamide
2',6'-DIHYDROXY-4'-METHOXYDIHYDROCHALCONE
Knerachelin A
(6Z,9Z,12Z,15Z)-1-(2,6-dihydroxy-4-methoxy-phenyl)octadeca-6,9,12,15-tetraen-1-one
2,6-Dihydroxy-4-methoxybenzophenone
2-heptadecyl-3,5-dimethoxy-phenol
4-(1'-GERANYLOXY)-BETA,2,6-TRIHYDROXYACETOPHENONE
2-Bromo-2',4'-dimethoxyacetophenone
1-(2-METHYLPROPANONE)-4-O-PRENYL-PHLOROGLUCINOL
| Title | Journal or Book | Year |
|---|---|---|
| Two New Compounds from Artemisia annua | Journal of Natural Products | 1992 |
| Ent-14[S],16β,17-trihydroxyatisan-3-one and further constituents from Euphorbia fidjiana | Phytochemistry | 1991 |
| Chemistry and crystal structure of leprolomin, a novel diphenyl ether from the lichen Psoroma leprolomum | Australian Journal of Chemistry | 1978 |
| 13C-NMR-spektren natürlich vorkommender flavonoide | Tetrahedron Letters | 1976 |
This compound is available in the following databases:
Mass Spectra of Flavors and Fragrances of Natural and Synthetic Compounds, 3rd Edition
Author: Luigi Mondello
FFNSC provides in-depth coverage of monoterpene and sesquiterpene hydrocarbons, their oxygenated derivatives, and aliphatic oxygenated compounds, essential components in flavor and fragrance research. Learn more.
Food, Flavors, Fragrances, and Related Compounds: GC-MS Library
Author: Wiley
With Wiley's Food, Flavors, Fragrances, and Related Compounds GC-MS Library, get access to GC-MS spectra with focused compound coverage including essential oils, lipids, volatile organic compounds, terpenes, herbicides, insecticides, and other compounds of importance for food, flavor, fragrance, and cannabis applications. Learn more.