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5-(1-Cyclopentenyl)-5-prop-2-enyl-1,3-diazinane-2,4,6-trione

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

5-(1-Cyclopentenyl)-5-prop-2-enyl-1,3-diazinane-2,4,6-trione
SpectraBase Compound ID 36eot7dKN4M
InChI InChI=1S/C12H14N2O3/c1-2-7-12(8-5-3-4-6-8)9(15)13-11(17)14-10(12)16/h2,5H,1,3-4,6-7H2,(H2,13,14,15,16,17)
InChIKey PGOFVNDJPVZHPV-UHFFFAOYSA-N
Mol Weight 234.25 g/mol
Molecular Formula C12H14N2O3
Exact Mass 234.100442 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID FuiqMZNoe7J
Name 5-(1-Cyclopentenyl)-5-prop-2-enyl-1,3-diazinane-2,4,6-trione
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 234.100442316 u
Formula C12H14N2O3
InChI InChI=1S/C12H14N2O3/c1-2-7-12(8-5-3-4-6-8)9(15)13-11(17)14-10(12)16/h2,5H,1,3-4,6-7H2,(H2,13,14,15,16,17)
InChIKey PGOFVNDJPVZHPV-UHFFFAOYSA-N
Molecular Weight 234.255 g/mol
SMILES C1(C(NC(NC1=O)=O)=O)(C1=CCCC1)CC=C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.853879