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5,5-Diethyl-2-isopropylimino-1-methyl-hexahydro-pyrimidine-4,6-dione
SpectraBase Compound ID H0F9yoVGCQ9
InChI InChI=1S/C12H21N3O2/c1-6-12(7-2)9(16)14-11(13-8(3)4)15(5)10(12)17/h8H,6-7H2,1-5H3,(H,13,14,16)
InChIKey YHOARGCNEUHLPY-UHFFFAOYSA-N
Mol Weight 239.32 g/mol
Molecular Formula C12H21N3O2
Exact Mass 239.163377 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 7PerCYRsfk
Name 5,5-Diethyl-2-isopropylimino-1-methyl-hexahydro-pyrimidine-4,6-dione
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 239.163376926 u
Formula C12H21N3O2
InChI InChI=1S/C12H21N3O2/c1-6-12(7-2)9(16)14-11(13-8(3)4)15(5)10(12)17/h8H,6-7H2,1-5H3,(H,13,14,16)
InChIKey YHOARGCNEUHLPY-UHFFFAOYSA-N
Molecular Weight 239.319 g/mol
SMILES C1(N(\C(NC(C1(CC)CC)=O)=N\C(C)C)C)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.910193