| SpectraBase Compound ID | 97ee4rFYqGX |
|---|---|
| InChI | InChI=1S/C15H22O3/c1-8-4-5-11(16)15(3)7-6-10-9(2)14(17)18-13(10)12(8)15/h4,9-13,16H,5-7H2,1-3H3/t9-,10-,11-,12+,13-,15-/m0/s1 |
| InChIKey | DGIMMEWTLSCNGO-ZDDLAMDLSA-N |
| Mol Weight | 250.34 g/mol |
| Molecular Formula | C15H22O3 |
| Exact Mass | 250.156895 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 8JK8HgDrK6Q |
|---|---|
| Name | Eudesm-3-en-12-oic acid, 1.alpha.,6.alpha.-dihydroxy-, .gamma.-lactone, (11S)- |
| Alternate Name(s) | Naphtho[1,2-b]furan-2(3H)-one, 3a,4,5,5a,6,7,9a,9b-octahydro-6-hydroxy-3,5a,9-trimethyl-, [3S-(3.alpha.,3a.alpha.,5a.beta.,6.alpha.,9a.alpha.,9b.beta.)]- (3S,3aS,5aR,6S,9aS,9bS)-6-hydroxy-3,5a,9-trimethyl-3a,4,5,5a,6,7,9a,9b-octahydronaphtho[1,2-b]furan-2(3H)-one 11,13-Dihydrodouglanin 4.alpha.-hydroxy-5.alpha.,6.beta.,7.alpha.,11.beta.H-eudesm-1-en-6,12-olide Alchanene Dihydrodouglanin |
| CAS Registry Number | 16886-42-3 |
| Comments | Less than 3 mono-isotopic peaks |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C15H22O3 |
| InChI | InChI=1S/C15H22O3/c1-8-4-5-11(16)15(3)7-6-10-9(2)14(17)18-13(10)12(8)15/h4,9-13,16H,5-7H2,1-3H3/t9-,10-,11-,12+,13-,15-/m0/s1 |
| InChIKey | DGIMMEWTLSCNGO-ZDDLAMDLSA-N |
| Molecular Weight | 250.338 g/mol |
| SMILES | O[C@@]1([C@]2([C@@]([C@]3(OC(=O)[C@]([C@@]3(CC2)[H])(C)[H])[H])(C(=CC1)C)[H])C)[H] |
| SPLASH | splash10-001i-0090000000-28d259ce954e9de5bec7 |
| Source of Spectrum | KC-1987-473-4 |
| Wiley ID | 1253670 |