![ETHYL-3-SEC.-BUTYL-2,5-DIOXO-2,3-DIHYDRO-5H-PYRROLO-[1,2-A]-ISOINDOLE-1-CARBOXYLATE;ISOMER-B](/api/spectrum/BqtySQqlQKG/structure.png?h=300&w=458 "ETHYL-3-SEC.-BUTYL-2,5-DIOXO-2,3-DIHYDRO-5H-PYRROLO-[1,2-A]-ISOINDOLE-1-CARBOXYLATE;ISOMER-B")
| SpectraBase Compound ID | JAnuMRRBToA |
|---|---|
| InChI | InChI=1S/C18H19NO4/c1-4-10(3)14-16(20)13(18(22)23-5-2)15-11-8-6-7-9-12(11)17(21)19(14)15/h6-10,14H,4-5H2,1-3H3 |
| InChIKey | IUNSLELRFTZZAS-UHFFFAOYSA-N |
| Mol Weight | 313.35 g/mol |
| Molecular Formula | C18H19NO4 |
| Exact Mass | 313.131408 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | BqtySQqlQKG |
|---|---|
| Name | ETHYL-3-SEC.-BUTYL-2,5-DIOXO-2,3-DIHYDRO-5H-PYRROLO-[1,2-A]-ISOINDOLE-1-CARBOXYLATE;ISOMER-B |
| Compound Number | 18E |
| Copyright | Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| InChI | InChI=1S/C18H19NO4/c1-4-10(3)14-16(20)13(18(22)23-5-2)15-11-8-6-7-9-12(11)17(21)19(14)15/h6-10,14H,4-5H2,1-3H3 |
| InChIKey | IUNSLELRFTZZAS-UHFFFAOYSA-N |
| Literature Reference | R.A.AITKEN,H.R.COOPER,A.P.MEHROTRA J.CHEM.SOC.PERKIN-1,475(1996) |
| Solvent | Chloroform-d |