![5,8a-Dimethyl-3-(4-phenyl-piperazin-1-ylmethyl)-3a,5,6,7,8,8a,9,9a-octahydro-3H-naphtho[2,3-b]furan-2-one](/api/spectrum/B7UTpyPKLi1/structure.png?h=300&w=458 "5,8a-Dimethyl-3-(4-phenyl-piperazin-1-ylmethyl)-3a,5,6,7,8,8a,9,9a-octahydro-3H-naphtho[2,3-b]furan-2-one")
| SpectraBase Compound ID | 7TnLv13FehP |
|---|---|
| InChI | InChI=1S/C25H34N2O2/c1-18-7-6-10-25(2)16-23-20(15-22(18)25)21(24(28)29-23)17-26-11-13-27(14-12-26)19-8-4-3-5-9-19/h3-5,8-9,15,18,20-21,23H,6-7,10-14,16-17H2,1-2H3 |
| InChIKey | KOEZUQWSZXYTHE-UHFFFAOYSA-N |
| Mol Weight | 394.6 g/mol |
| Molecular Formula | C25H34N2O2 |
| Exact Mass | 394.262028 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | B7UTpyPKLi1 |
|---|---|
| Name | 5,8a-Dimethyl-3-(4-phenyl-piperazin-1-ylmethyl)-3a,5,6,7,8,8a,9,9a-octahydro-3H-naphtho[2,3-b]furan-2-one |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C25H34N2O2 |
| InChI | InChI=1S/C25H34N2O2/c1-18-7-6-10-25(2)16-23-20(15-22(18)25)21(24(28)29-23)17-26-11-13-27(14-12-26)19-8-4-3-5-9-19/h3-5,8-9,15,18,20-21,23H,6-7,10-14,16-17H2,1-2H3 |
| InChIKey | KOEZUQWSZXYTHE-UHFFFAOYSA-N |
| Molecular Weight | 394.559 g/mol |
| SMILES | C1(C(OC2C1C=C1C(CCCC1(C2)C)C)=O)CN1CCN(CC1)c1ccccc1 |
| SPLASH | splash10-05di-4900000000-62731b9a243cd82454b7 |
| Synonyms | 5,8a-dimethyl-3-[(4-phenyl-1-piperazinyl)methyl]-3,3a,5,6,7,8,9,9a-octahydrobenzo[f]benzofuran-2-one 5,8a-dimethyl-3-[(4-phenylpiperazin-1-yl)methyl]-3,3a,5,6,7,8,9,9a-octahydrobenzo[f]benzofuran-2-one 5,8a-dimethyl-3-[(4-phenylpiperazin-1-yl)methyl]-3,3a,5,6,7,8,9,9a-octahydrobenzo[f][1]benzofuran-2-one 5,8a-dimethyl-3-[(4-phenylpiperazino)methyl]-3,3a,5,6,7,8,9,9a-octahydrobenzo[f]benzofuran-2-one |
| Wiley ID | 1437620 |