| SpectraBase Compound ID | I5Z3wTbefwi |
|---|---|
| InChI | InChI=1S/C22H23NO4/c1-15(24)17-9-5-10-19-18(17)13-20(21-11-6-12-26-21)23(19)22(25)27-14-16-7-3-2-4-8-16/h2-8,10-12,17-20H,9,13-14H2,1H3/t17-,18-,19+,20+/m1/s1 |
| InChIKey | ONWSWFUGBNWEHR-ZRNYENFQSA-N |
| Mol Weight | 365.43 g/mol |
| Molecular Formula | C22H23NO4 |
| Exact Mass | 365.162708 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | DHPwrclvWkc |
|---|---|
| Name | Benzyl rac-(2S,3aR,4S,7aS)-4-acetyl-2-(furan-2-yl)-2,3,3a,4,5,7ahexahydro-1H-indole-1-carboxylate |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C22H23NO4 |
| InChI | InChI=1S/C22H23NO4/c1-15(24)17-9-5-10-19-18(17)13-20(21-11-6-12-26-21)23(19)22(25)27-14-16-7-3-2-4-8-16/h2-8,10-12,17-20H,9,13-14H2,1H3/t17-,18-,19+,20+/m1/s1 |
| InChIKey | ONWSWFUGBNWEHR-ZRNYENFQSA-N |
| Molecular Weight | 365.429 g/mol |
| SMILES | [C@@]12(N([C@@](C[C@@]2([C@@](C(=O)C)(CC=C1)[H])[H])(c1occc1)[H])C(OCc1ccccc1)=O)[H] |
| SPLASH | splash10-00dl-5190000000-dc3faff1c46c2efe64e1 |
| Source of Spectrum | U1-2011-6563-27 |
| Synonyms | (2S,3aR,4S,7aS)-4-acetyl-2-(2-furanyl)-2,3,3a,4,5,7a-hexahydroindole-1-carboxylic acid (phenylmethyl) ester benzyl (2S,3aR,4S,7aS)-4-acetyl-2-(furan-2-yl)-2,3,3a,4,5,7a-hexahydroindole-1-carboxylate benzyl (2S,3aR,4S,7aS)-4-acetyl-2-(2-furyl)-2,3,3a,4,5,7a-hexahydroindole-1-carboxylate (phenylmethyl) (2S,3aR,4S,7aS)-4-ethanoyl-2-(furan-2-yl)-2,3,3a,4,5,7a-hexahydroindole-1-carboxylate |
| Wiley ID | 1703051 |