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1H-Pyrimido[4,5-d]pyrimidine-2,4-dione, 1,3-dimethyl-6-(2-morpholin-4-ylethyl)-5,6,7,8-tetrahydro-
SpectraBase Compound ID 6PonU3wG1MC
InChI InChI=1S/C14H23N5O3/c1-16-12-11(13(20)17(2)14(16)21)9-19(10-15-12)4-3-18-5-7-22-8-6-18/h15H,3-10H2,1-2H3
InChIKey JFENSIRLFCIEOB-UHFFFAOYSA-N
Mol Weight 309.37 g/mol
Molecular Formula C14H23N5O3
Exact Mass 309.18009 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID EW6v4r3HZxv
Name 1H-Pyrimido[4,5-D]pyrimidine-2,4-dione, 1,3-dimethyl-6-(2-morpholin-4-ylethyl)-5,6,7,8-tetrahydro-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 309.180089618 u
Formula C14H23N5O3
InChI InChI=1S/C14H23N5O3/c1-16-12-11(13(20)17(2)14(16)21)9-19(10-15-12)4-3-18-5-7-22-8-6-18/h15H,3-10H2,1-2H3
InChIKey JFENSIRLFCIEOB-UHFFFAOYSA-N
Molecular Weight 309.370 g/mol
SMILES C12=C(C(=O)N(C(N2C)=O)C)CN(CN1)CCN1CCOCC1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.89004