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5-Benzyl-1-(2-methylallyloxymethyl)-6-azauracil

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

5-Benzyl-1-(2-methylallyloxymethyl)-6-azauracil
SpectraBase Compound ID H9fHCt7ZU3F
InChI InChI=1S/C15H17N3O3/c1-11(2)9-21-10-18-15(20)16-14(19)13(17-18)8-12-6-4-3-5-7-12/h3-7H,1,8-10H2,2H3,(H,16,19,20)
InChIKey IPRRZFGWPVGMBA-UHFFFAOYSA-N
Mol Weight 287.32 g/mol
Molecular Formula C15H17N3O3
Exact Mass 287.126991 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID EUGD95sV7xX
Name 5-Benzyl-1-(2-methylallyloxymethyl)-6-azauracil
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 287.126991416 u
Formula C15H17N3O3
InChI InChI=1S/C15H17N3O3/c1-11(2)9-21-10-18-15(20)16-14(19)13(17-18)8-12-6-4-3-5-7-12/h3-7H,1,8-10H2,2H3,(H,16,19,20)
InChIKey IPRRZFGWPVGMBA-UHFFFAOYSA-N
SMILES C1(=O)NC(=O)C(=NN1COCC(C)=C)CC1=CC=CC=C1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.94622