![3-Fluoro-8-isopropyl-8,9,10,11-tetrahydro-5H-8,11-diazacycloocta[a]indene-6,7-dicarboxylic acid, dimethyl ester](/api/spectrum/fymmzdHbqR/structure.png?h=300&w=458 "3-Fluoro-8-isopropyl-8,9,10,11-tetrahydro-5H-8,11-diazacycloocta[a]indene-6,7-dicarboxylic acid, dimethyl ester")
| SpectraBase Compound ID | IANXaCZtFl7 |
|---|---|
| InChI | InChI=1S/C20H23FN2O4/c1-11(2)23-8-7-17-14(13-9-12(21)5-6-16(13)22-17)10-15(19(24)26-3)18(23)20(25)27-4/h5-6,9,11,22H,7-8,10H2,1-4H3/b18-15+ |
| InChIKey | JMLOVPWQLASHGR-OBGWFSINSA-N |
| Mol Weight | 374.41 g/mol |
| Molecular Formula | C20H23FN2O4 |
| Exact Mass | 374.164185 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | fymmzdHbqR |
|---|---|
| Name | 3-Fluoro-8-isopropyl-8,9,10,11-tetrahydro-5H-8,11-diazacycloocta[a]indene-6,7-dicarboxylic acid, dimethyl ester |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C20H23FN2O4 |
| InChI | InChI=1S/C20H23FN2O4/c1-11(2)23-8-7-17-14(13-9-12(21)5-6-16(13)22-17)10-15(19(24)26-3)18(23)20(25)27-4/h5-6,9,11,22H,7-8,10H2,1-4H3/b18-15+ |
| InChIKey | JMLOVPWQLASHGR-OBGWFSINSA-N |
| Molecular Weight | 374.412 g/mol |
| SMILES | [nH]1c2ccc(cc2c2c1CCN(\C(=C/(C2)C(=O)OC)C(=O)OC)C(C)C)F |
| SPLASH | splash10-03k9-3965000000-9ca0f6c521435d9a220e |
| Synonyms | (4E)-8-fluoro-3-isopropyl-1,2,6,11-tetrahydroazocin[4,5-b]indole-4,5-dicarboxylic acid dimethyl ester (4E)-8-fluoro-3-propan-2-yl-1,2,6,11-tetrahydroazocino[4,5-b]indole-4,5-dicarboxylic acid dimethyl ester Dimethyl (4E)-8-fluoranyl-3-propan-2-yl-1,2,6,11-tetrahydroazocino[4,5-b]indole-4,5-dicarboxylate Dimethyl (4E)-8-fluoro-3-isopropyl-1,2,6,11-tetrahydroazocino[4,5-b]indole-4,5-dicarboxylate Dimethyl (4E)-8-fluoro-3-propan-2-yl-1,2,6,11-tetrahydroazocino[4,5-b]indole-4,5-dicarboxylate |
| Wiley ID | 1440443 |