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{2-[(Z)-(1-(4-methylphenyl)-2,4,6-trioxotetrahydro-5(2H)-pyrimidinylidene)methyl]phenoxy}acetonitrile
SpectraBase Compound ID 3NIdEBf7pRX
InChI InChI=1S/C20H15N3O4/c1-13-6-8-15(9-7-13)23-19(25)16(18(24)22-20(23)26)12-14-4-2-3-5-17(14)27-11-10-21/h2-9,12H,11H2,1H3,(H,22,24,26)/b16-12-
InChIKey BEGBMWNZKMTWQT-VBKFSLOCSA-N
Mol Weight 361.36 g/mol
Molecular Formula C20H15N3O4
Exact Mass 361.106256 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 2kxNZ6om8Ph
Name {2-[(Z)-(1-(4-methylphenyl)-2,4,6-trioxotetrahydro-5(2H)-pyrimidinylidene)methyl]phenoxy}acetonitrile
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/C20H15N3O4/c1-13-6-8-15(9-7-13)23-19(25)16(18(24)22-20(23)26)12-14-4-2-3-5-17(14)27-11-10-21/h2-9,12H,11H2,1H3,(H,22,24,26)/b16-12-
InChIKey BEGBMWNZKMTWQT-VBKFSLOCSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_16751
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: UZI/8177911; UBI_ID: UBI-016754
Synonyms {2-[(1-(4-methylphenyl)-2,4,6-trioxotetrahydro-5(2H)-pyrimidinylidene)methyl]phenoxy}acetonitrile
Temperature 308 °C