| SpectraBase Compound ID | 2YTiawpRfnz |
|---|---|
| InChI | InChI=1S/C22H24O2/c1-24-20(23)12-18-17-10-9-16-15(13-5-3-2-4-6-13)8-7-14-11-19(18)22(17)21(14)16/h2-10,14-19,21-22H,11-12H2,1H3/t14-,15+,16+,17-,18-,19+,21-,22-/m1/s1 |
| InChIKey | NFSUUSHZEPLFRY-ZYPKZSTESA-N |
| Mol Weight | 320.43 g/mol |
| Molecular Formula | C22H24O2 |
| Exact Mass | 320.17763 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 2XQOzsqNQu |
|---|---|
| Name | endiandric acid A methyl ester |
| Alternate Name(s) | ((1S,1aS,2aS,5R,5aR,7aR,7bS,7cS)-5-Phenyl-1a,2,2a,5,5a,7a,7b,7c-octahydro-1H-cyclobuta[bc]acenaphthylen-1-yl)-acetic acid methyl ester Methyl[(1S,5R,5aR,7aR,7bS,7cS)-5-phenyl-1a,2,2a,5,5a,7a,7b,7c-octahydro-1H-cyclobuta[bc]acenaphthylen-1-yl]acetate |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C22H24O2 |
| InChI | InChI=1S/C22H24O2/c1-24-20(23)12-18-17-10-9-16-15(13-5-3-2-4-6-13)8-7-14-11-19(18)22(17)21(14)16/h2-10,14-19,21-22H,11-12H2,1H3/t14-,15+,16+,17-,18-,19+,21-,22-/m1/s1 |
| InChIKey | NFSUUSHZEPLFRY-ZYPKZSTESA-N |
| Molecular Weight | 320.432 g/mol |
| SMILES | [C@@]12([C@]3([C@@]4([C@](c5ccccc5)(C=C[C@]3([H])C[C@@]1([H])[C@@]([C@]2(C=C4)[H])(CC(=O)OC)[H])[H])[H])[H])[H] |
| SPLASH | splash10-014l-3900000000-6c6abdfc8bcb323ae134 |
| Source of Spectrum | B-47-587-0 |
| Wiley ID | 1320632 |