| SpectraBase Compound ID | 5u9nmbMmsJP |
|---|---|
| InChI | InChI=1S/C15H20O4/c1-8-4-11(16)7-15(3)12(8)5-10(6-13(15)17)9(2)14(18)19/h4,10,12-13,17H,2,5-7H2,1,3H3,(H,18,19)/t10?,12?,13-,15-/m0/s1 |
| InChIKey | ODYPPTWKBZBLKA-KSCOTYGWSA-N |
| Mol Weight | 264.32 g/mol |
| Molecular Formula | C15H20O4 |
| Exact Mass | 264.136159 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 82hE97bpBjQ |
|---|---|
| Name | 9.beta.-Hydroxy-2-oxo-isocostic Acid |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C15H20O4 |
| InChI | InChI=1S/C15H20O4/c1-8-4-11(16)7-15(3)12(8)5-10(6-13(15)17)9(2)14(18)19/h4,10,12-13,17H,2,5-7H2,1,3H3,(H,18,19)/t10?,12?,13-,15-/m0/s1 |
| InChIKey | ODYPPTWKBZBLKA-KSCOTYGWSA-N |
| Molecular Weight | 264.321 g/mol |
| SMILES | O[C@]1(CC(C(C(=O)O)=C)CC2[C@@]1(CC(C=C2C)=O)C)[H] |
| SPLASH | splash10-0072-2960000000-88281c023ecb8500294f |
| Source of Spectrum | G4-61-800-4 |
| Synonyms | 4,9-Dimethyl-6-[1'-(hydroxycarbonyl)ethenyl]-8-hydroxy-1,2,5,6,7,8-hexahydronaphthalen-2-onee 2-[(4S,4aS)-4-hydroxy-4a,8-dimethyl-6-oxo-1,2,3,4,5,8a-hexahydronaphthalen-2-yl]-2-propenoic acid 2-[(4S,4aS)-4-hydroxy-4a,8-dimethyl-6-oxo-1,2,3,4,5,8a-hexahydronaphthalen-2-yl]prop-2-enoic acid 2-[(4S,4aS)-4a,8-dimethyl-4-oxidanyl-6-oxidanylidene-1,2,3,4,5,8a-hexahydronaphthalen-2-yl]prop-2-enoic acid |
| Wiley ID | 1607307 |