![3-Benzylhexahydropyrrolo[1,2-A]pyrazine-1,4-dione, me derivative](/api/spectrum/1Pc9L2hNPx7/structure.png?h=300&w=458 "3-Benzylhexahydropyrrolo[1,2-A]pyrazine-1,4-dione, me derivative")
| SpectraBase Compound ID | 8ALUcYUHCsJ |
|---|---|
| InChI | InChI=1S/C15H18N2O2/c1-16-13(10-11-6-3-2-4-7-11)15(19)17-9-5-8-12(17)14(16)18/h2-4,6-7,12-13H,5,8-10H2,1H3 |
| InChIKey | VESAPQFPVCNWRR-UHFFFAOYSA-N |
| Mol Weight | 258.32 g/mol |
| Molecular Formula | C15H18N2O2 |
| Exact Mass | 258.136828 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1Pc9L2hNPx7 |
|---|---|
| Name | 3-Benzylhexahydropyrrolo[1,2-A]pyrazine-1,4-dione, me derivative |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 258.136827826 u |
| Formula | C15H18N2O2 |
| InChI | InChI=1S/C15H18N2O2/c1-16-13(10-11-6-3-2-4-7-11)15(19)17-9-5-8-12(17)14(16)18/h2-4,6-7,12-13H,5,8-10H2,1H3 |
| InChIKey | VESAPQFPVCNWRR-UHFFFAOYSA-N |
| Molecular Weight | 258.321 g/mol |
| SMILES | C12C(N(C(C(N2CCC1)=O)CC1=CC=CC=C1)C)=O |