| SpectraBase Spectrum ID |
HovCifDOvHy |
| Name |
N-[1-(3-Benzyl-1,4-dioxo-6,7,8,8A-tetrahydro-3H-pyrrolo[1,2-A]pyrazin-2-yl)-1-oxopropan-2-yl]-2-phenylacetamide |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
433.200156357 u |
| Formula |
C25H27N3O4 |
| InChI |
InChI=1S/C25H27N3O4/c1-17(26-22(29)16-19-11-6-3-7-12-19)23(30)28-21(15-18-9-4-2-5-10-18)24(31)27-14-8-13-20(27)25(28)32/h2-7,9-12,17,20-21H,8,13-16H2,1H3,(H,26,29) |
| InChIKey |
LWGOLULGLXQUOZ-UHFFFAOYSA-N |
| Molecular Weight |
433.508 g/mol |
| SMILES |
C1(N(C(C(N2CCCC12)=O)CC1=CC=CC=C1)C(C(NC(=O)CC=1C=CC=CC1)C)=O)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.977986 |
![N-[1-(3-benzyl-1,4-dioxo-6,7,8,8a-tetrahydro-3H-pyrrolo[1,2-a]pyrazin-2-yl)-1-oxopropan-2-yl]-2-phenylacetamide](/api/spectrum/HovCifDOvHy/structure.png?h=300&w=458 "N-[1-(3-benzyl-1,4-dioxo-6,7,8,8a-tetrahydro-3H-pyrrolo[1,2-a]pyrazin-2-yl)-1-oxopropan-2-yl]-2-phenylacetamide")
