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5-[3-Cyclohexenylmethyleneamino]-4-amino-1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydropyrimidine

View entire compound with spectra: 1 FTIR

5-[3-Cyclohexenylmethyleneamino]-4-amino-1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydropyrimidine
SpectraBase Compound ID DNAOp57S9cy
InChI InChI=1S/C13H18N4O2/c1-16-11(14)10(12(18)17(2)13(16)19)15-8-9-6-4-3-5-7-9/h3-4,8-9H,5-7,14H2,1-2H3/b15-8+
InChIKey ZRHMIAGBVPXRHL-OVCLIPMQSA-N
Mol Weight 262.31 g/mol
Molecular Formula C13H18N4O2
Exact Mass 262.142976 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID LcmboOO22Sf
Name 5-[3-Cyclohexenylmethyleneamino]-4-amino-1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydropyrimidine
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 262.142975834 u
Formula C13H18N4O2
InChI InChI=1S/C13H18N4O2/c1-16-11(14)10(12(18)17(2)13(16)19)15-8-9-6-4-3-5-7-9/h3-4,8-9H,5-7,14H2,1-2H3/b15-8+
InChIKey ZRHMIAGBVPXRHL-OVCLIPMQSA-N
SMILES C1(N(C(C(=C(N1C)N)\N=C\C1CCC=CC1)=O)C)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.81809