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5-Benzylamino-1,3-dimethyl-5-phenylbarbituric-acid
SpectraBase Compound ID CowOOPzsGz
InChI InChI=1S/C19H19N3O3/c1-21-16(23)19(15-11-7-4-8-12-15,17(24)22(2)18(21)25)20-13-14-9-5-3-6-10-14/h3-12,20H,13H2,1-2H3
InChIKey RASQLLXDKUSNQI-UHFFFAOYSA-N
Mol Weight 337.38 g/mol
Molecular Formula C19H19N3O3
Exact Mass 337.142641 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID KZChKZIPNwh
Name 5-Benzylamino-1,3-dimethyl-5-phenylbarbituric-acid
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 337.142641481 u
Formula C19H19N3O3
InChI InChI=1S/C19H19N3O3/c1-21-16(23)19(15-11-7-4-8-12-15,17(24)22(2)18(21)25)20-13-14-9-5-3-6-10-14/h3-12,20H,13H2,1-2H3
InChIKey RASQLLXDKUSNQI-UHFFFAOYSA-N
Molecular Weight 337.379 g/mol
SMILES C1(=O)N(C(=O)C(C(=O)N1C)(C1=CC=CC=C1)NCC1=CC=CC=C1)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.966787