Daphnetin
Compound with spectra: 8 NMR, 1 FTIR, 1 Raman, and 3 MS (GC)
| SpectraBase Compound ID | Di5Ub4I28lp |
|---|---|
| InChI | InChI=1S/C9H6O4/c10-6-3-1-5-2-4-7(11)13-9(5)8(6)12/h1-4,10,12H |
| InChIKey | ATEFPOUAMCWAQS-UHFFFAOYSA-N |
| Mol Weight | 178.14 g/mol |
| Molecular Formula | C9H6O4 |
| Exact Mass | 178.026609 g/mol |
| Copyright | Copyright © 2012-2024 John Wiley & Sons, Inc. All Rights Reserved. |
|---|---|
| Source of Sample | Indofine Chemical Company, Inc. |
| Source of Spectrum | Forensic Spectral Research |
| Catalog Number | D-109 |
| Copyright | Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved. |
|---|---|
| Source of Sample | H. Duddeck, M. Kaiser Org. Magn. Resonance 20, 55 (1982) |
| Solvent | Dimethyl sulfoxide-d6; Reference=TMS; Temperature=Ambient Spectrometer= Not Reported |
| 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 | DMSO |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
|---|---|
| Solvent | DMSO-D6 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
|---|
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
|---|
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
|---|---|
| Solvent | CDCl3 |
| Copyright | Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved. |
|---|---|
| Solvent | DMSO-d6 |
| Copyright | Copyright © 2014-2024 John Wiley & Sons, Inc. All Rights Reserved. |
|---|---|
| Source of Sample | Indofine Chemical Company, Inc. |
| Source of Spectrum | Forensic Spectral Research |
| Catalog Number | D-109 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
|---|---|
| Source of Spectrum | NP-2-8558-0 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
|---|---|
| Source of Spectrum | CD-354-0-0 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
|---|---|
| Source of Spectrum | W5-1989-32893-32643 |
- 7,8-Dihydroxy-coumarin
- DIHYDROXY-COUMARIN
- ATEFPOUAMCWAQS-UHFFFAOYSA-N
- 7,8-DIHYDROXYCOUMARIN,(DAPHNETIN)
- DAPHNETIN;7,8-DIHYDROXY-2H-CHROMEN-2-ONE
- COUMARIN, 7,8-DIHYDROXY-,
- 7,8-dihydroxy-2H-chromen-2-one
8-Iodo-umbelliferone
8-(Methoxymethyleneoxy)coumarin
7-(1,1-Dimethyl-allyloxy)-coumarin
7-(cyclohexylmethoxy)-1-benzopyran-2-one
Crellisin B
trans-2,3,4-TRIMETHOXYCINNAMIC ACID
7-(3,3-Dimethyl-2-oxobutoxy)-2H-1-benzopyran-2-one
2H-1-Benzopyran-2-one, 7-[(5-phenylpentyl)oxy]-
Umbelliprenin
7-O-(3'-acetoxymethyl-1'(E)-butenyl)umbelliferone
| Title | Journal or Book | Year |
|---|---|---|
| Total Synthesis of Six 3,4-Unsubstituted Coumarins | Molecules | 2013 |
| Identification and Characterization of Human UDP-Glucuronosyltransferases Responsible for the In Vitro Glucuronidation of Daphnetin | Drug Metabolism and Disposition | 2010 |
| NMR spectral analysis of polyphenols from Punica granatum | Phytochemistry | 1994 |
| 13C NMR spectroscopy of coumarin derivatives | Organic Magnetic Resonance | 1982 |
This compound is available in the following databases:
KnowItAll NMR Spectral Library
Author: Wiley
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KnowItAll IR, Raman, and UV-Vis Spectral Libraries
Author: Wiley
The KnowItAll IR, Raman, and UV-Vis spectral libraries offer access to the world's largest collection of IR, Raman, and UV-Vis spectra, including the renowned Sadtler spectra. The libraries include a wide range of compounds from pure organics to industrial compounds. Learn more.
KnowItAll Mass Spectral Library
Author: Wiley
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