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3-Benzyloxycarbonyl-3-ethyl-1-methylpiperazine-2,5-dione

View entire compound with spectra: 1 FTIR, and 1 MS (GC)

3-Benzyloxycarbonyl-3-ethyl-1-methylpiperazine-2,5-dione
SpectraBase Compound ID X1RU8EcWPv
InChI InChI=1S/C15H18N2O4/c1-3-15(13(19)17(2)9-12(18)16-15)14(20)21-10-11-7-5-4-6-8-11/h4-8H,3,9-10H2,1-2H3,(H,16,18)
InChIKey IIMAHAOURXDMNU-UHFFFAOYSA-N
Mol Weight 290.32 g/mol
Molecular Formula C15H18N2O4
Exact Mass 290.126657 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID ANVM5ChyDZo
Name 3-Benzyloxycarbonyl-3-ethyl-1-methylpiperazine-2,5-dione
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 290.126657064 u
Formula C15H18N2O4
InChI InChI=1S/C15H18N2O4/c1-3-15(13(19)17(2)9-12(18)16-15)14(20)21-10-11-7-5-4-6-8-11/h4-8H,3,9-10H2,1-2H3,(H,16,18)
InChIKey IIMAHAOURXDMNU-UHFFFAOYSA-N
SMILES C1(N(CC(NC1(CC)C(=O)OCC=1C=CC=CC1)=O)C)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.959046