![(Z)-Methyl 2-((4aR,8aR)-hexahydrocyclohexa[b]-3-oxopiperazin-2(1H,2H,4H)-ylidene)-acetate](/api/spectrum/2TNn1PD7xbq/structure.png?h=300&w=458 "(Z)-Methyl 2-((4aR,8aR)-hexahydrocyclohexa[b]-3-oxopiperazin-2(1H,2H,4H)-ylidene)-acetate")
| SpectraBase Compound ID | 52vf4nVquuD |
|---|---|
| InChI | InChI=1S/C11H16N2O3/c1-16-10(14)6-9-11(15)13-8-5-3-2-4-7(8)12-9/h6-8,12H,2-5H2,1H3,(H,13,15)/b9-6-/t7-,8-/m1/s1 |
| InChIKey | PUHJBOPVEDEGAS-UYBBYJHHSA-N |
| Mol Weight | 224.26 g/mol |
| Molecular Formula | C11H16N2O3 |
| Exact Mass | 224.116092 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 2TNn1PD7xbq |
|---|---|
| Name | (Z)-Methyl 2-((4aR,8aR)-hexahydrocyclohexa[b]-3-oxopiperazin-2(1H,2H,4H)-ylidene)-acetate |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C11H16N2O3 |
| InChI | InChI=1S/C11H16N2O3/c1-16-10(14)6-9-11(15)13-8-5-3-2-4-7(8)12-9/h6-8,12H,2-5H2,1H3,(H,13,15)/b9-6-/t7-,8-/m1/s1 |
| InChIKey | PUHJBOPVEDEGAS-UYBBYJHHSA-N |
| Molecular Weight | 224.260 g/mol |
| SMILES | N1[C@]2([C@](N\C(C1=O)=C/C(=O)OC)(CCCC2)[H])[H] |
| SPLASH | splash10-006x-9480000000-e294b0414719b7b05fe1 |
| Source of Spectrum | F-62-6790-39 |
| Synonyms | (2Z)-2-[(4aR,8aR)-3-oxo-1,4,4a,5,6,7,8,8a-octahydroquinoxalin-2-ylidene]acetic acid methyl ester Methyl (2Z)-2-[(4aR,8aR)-3-oxo-1,4,4a,5,6,7,8,8a-octahydroquinoxalin-2-ylidene]acetate Methyl (2Z)-2-[(4aR,8aR)-3-oxidanylidene-1,4,4a,5,6,7,8,8a-octahydroquinoxalin-2-ylidene]ethanoate |
| Wiley ID | 1634104 |