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(5E)-1-benzyl-5-{1-[(3-hydroxypropyl)amino]ethylidene}-2,4,6(1H,3H,5H)-pyrimidinetrione
SpectraBase Compound ID 1tYtJQQ4Wz9
InChI InChI=1S/C16H19N3O4/c1-11(17-8-5-9-20)13-14(21)18-16(23)19(15(13)22)10-12-6-3-2-4-7-12/h2-4,6-7,17,20H,5,8-10H2,1H3,(H,18,21,23)/b13-11+
InChIKey JWPXKNDUNOWWQP-ACCUITESSA-N
Mol Weight 317.35 g/mol
Molecular Formula C16H19N3O4
Exact Mass 317.137556 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 4A6ovlZFf1D
Name (5E)-1-benzyl-5-{1-[(3-hydroxypropyl)amino]ethylidene}-2,4,6(1H,3H,5H)-pyrimidinetrione
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C16H19N3O4/c1-11(17-8-5-9-20)13-14(21)18-16(23)19(15(13)22)10-12-6-3-2-4-7-12/h2-4,6-7,17,20H,5,8-10H2,1H3,(H,18,21,23)/b13-11+
InChIKey JWPXKNDUNOWWQP-ACCUITESSA-N
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_28536
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: D86151; Labnumber: KKA-0212A-0319; SBI_ID: SBI-028540
Synonyms 1-benzyl-5-{1-[(3-hydroxypropyl)amino]ethylidene}-2,4,6(1H,3H,5H)-pyrimidinetrione
Temperature 306 °C