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N-(1-isopropyl-2,4,6-triketo-5-methyl-hexahydropyrimidin-5-yl)acetamide

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

N-(1-isopropyl-2,4,6-triketo-5-methyl-hexahydropyrimidin-5-yl)acetamide
SpectraBase Compound ID 5A99ynfUlU7
InChI InChI=1S/C10H15N3O4/c1-5(2)13-8(16)10(4,12-6(3)14)7(15)11-9(13)17/h5H,1-4H3,(H,12,14)(H,11,15,17)
InChIKey BTEISXQMRGSKJS-UHFFFAOYSA-N
Mol Weight 241.25 g/mol
Molecular Formula C10H15N3O4
Exact Mass 241.106256 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 7Wdhc9Og7hm
Name N-(1-Isopropyl-2,4,6-triketo-5-methyl-hexahydropyrimidin-5-yl)acetamide
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 241.106255971 u
Formula C10H15N3O4
InChI InChI=1S/C10H15N3O4/c1-5(2)13-8(16)10(4,12-6(3)14)7(15)11-9(13)17/h5H,1-4H3,(H,12,14)(H,11,15,17)
InChIKey BTEISXQMRGSKJS-UHFFFAOYSA-N
Molecular Weight 241.247 g/mol
SMILES C1(N(C(C(C(N1)=O)(NC(=O)C)C)=O)C(C)C)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.983844