1,3-Isochromandione
Compound with spectra: 4 NMR, 4 FTIR, 1 Raman, and 1 MS (GC)
| SpectraBase Compound ID | H9ob12grXkf |
|---|---|
| InChI | InChI=1S/C9H6O3/c10-8-5-6-3-1-2-4-7(6)9(11)12-8/h1-4H,5H2 |
| InChIKey | AKHSBAVQPIRVAG-UHFFFAOYSA-N |
| Mol Weight | 162.14 g/mol |
| Molecular Formula | C9H6O3 |
| Exact Mass | 162.031694 g/mol |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
|---|---|
| Solvent | DMSO-D6 |
| Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
|---|---|
| Solvent | Polysol |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
|---|---|
| Solvent | CH3CN |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
|---|---|
| Solvent | CH2Cl2 |
| Copyright | Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved. |
|---|---|
| Source of Sample | Sherk Chemicals, Florence, Italy |
| Catalog Number | A 30 |
| Technique | KBr WAFER |
| Copyright | Copyright © 2018-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2018-2024 John Wiley & Sons, Inc. All Rights Reserved. |
|---|---|
| Source of Sample | Aldrich |
| Source of Spectrum | Sigma-Aldrich Co. LLC. |
| Catalog Number | 128589 |
| Technique | Mull |
| 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 | H1346 |
| Copyright | Copyright © 2018-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2018-2024 John Wiley & Sons, Inc. All Rights Reserved. |
|---|---|
| Source of Sample | Aldrich |
| Catalog Number | 128589 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
|---|---|
| Source of Spectrum | JX-2012-171 |
| Copyright | Copyright © 2017-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2017-2024 John Wiley & Sons, Inc. All Rights Reserved. |
|---|---|
| Catalog Number | 128589 |
- HOMOPHTHALIC-ANHYDRIDE;1H-2-BENZOPYRAN-1,3(4H)-DIONE
- alpha-CARBOXY-o-TOLUIC ACID, CYCLIC ANHYDRIDE
- O-TOLUIC ACID, A-CARBOXY-, CYCLIC ANHYDRIDE
- Homophthalic anhydride
- isochroman-1,3-dione
- 2-Carboxyphenylacetic anhydride
Methyl 2-(2-Oxotridecyl)benzoate
tert-Butyl 2-(2-Methylprop-2-en-1-yl)benzoate
1H-2-Benzopyran-1-one, 3,4-dihydro-3-methyl-
Methyl 2-(2-butyrylphenyl)acetate
8,9,10,12,13,14,15,16,17-Decahydro-7H-6-oxabenzo-cyclopentadecen-5-one
2-[2'-Oxo-3'-butenyl-(4'-phenyl)]benzoic acid
alpha-BENZOYL-o-TOLUIC ACID
2-(3-Ethoxy-3-keto-propyl)benzoic acid ethyl ester
3,4-dihydro-6-methylisocoumarin
6-Bromoisochroman-1-one
| Title | Journal or Book | Year |
|---|---|---|
| 17O NMR spectroscopy (natural abundance) of heterocycles: Anhydrides | Magnetic Resonance in Chemistry | 1986 |
This compound is available in the following databases:
Sigma-Aldrich Library of Raman Spectra
Author: Wiley/Sigma-Aldrich
Wiley, on behalf of Merck KGaA Darmstadt, Germany, releases the Sigma-Aldrich Library of Raman Spectra, featuring over 6,480 high-quality Raman spectra. Learn more.
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 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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