| SpectraBase Compound ID | 63dLFsK36R6 |
|---|---|
| InChI | InChI=1S/C12H12O5/c1-6-3-7-8(4-13)10(14)12(2,16)11(15)9(7)5-17-6/h3-5,11,15-16H,1-2H3 |
| InChIKey | QVMUHZHZYCDMAI-UHFFFAOYSA-N |
| Mol Weight | 236.22 g/mol |
| Molecular Formula | C12H12O5 |
| Exact Mass | 236.068473 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | AzxG7feEMWu |
|---|---|
| Name | Austdiol |
| Alternate Name(s) | (7R,8S)-7,8-dihydro-7,8-dihydroxy-3,7-dimethyl-6-oxo-6H-2-benzopyran-5-carbaldehyde (7R-e)-7,8-dihydro-7,8-dihydroxy-3,7-dimethyl-6-oxo-6H-2-benzopyran-5-carboxaldehyde 3,7-Dimethyl-7,8-bis(oxidanyl)-6-oxidanylidene-8H-isochromene-5-carbaldehyde 6H-2-benzopyran-5-carboxaldehyde, 7,8-dihydro-7,8-dihydroxy-3,7-dimethyl-6-oxo-, (7R-trans)- 7,8-Dihydroxy-3,7-dimethyl-6-oxo-8H-2-benzopyran-5-carboxaldehyde 7,8-Dihydroxy-3,7-dimethyl-6-oxo-8H-isochromene-5-carbaldehyde 7,8-Dihydroxy-6-keto-3,7-dimethyl-8H-isochromene-5-carbaldehyde Austadiol Austidiol BRN 1383761 NSC 159632 |
| CAS Registry Number | 53043-28-0 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C12H12O5 |
| InChI | InChI=1S/C12H12O5/c1-6-3-7-8(4-13)10(14)12(2,16)11(15)9(7)5-17-6/h3-5,11,15-16H,1-2H3 |
| InChIKey | QVMUHZHZYCDMAI-UHFFFAOYSA-N |
| Molecular Weight | 236.223 g/mol |
| SMILES | OC1C2=COC(=CC2=C(C(C1(C)O)=O)C=O)C |
| SPLASH | splash10-0006-9820000000-c37576e5adbd93ca6069 |
| Source of Spectrum | MY-1981-0-0 |
| Wiley ID | 1237802 |