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pyrido[2,3-d]pyrimidin-4(1H)-one, 1-[2-(3,4-diethoxyphenyl)ethyl]-5-(difluoromethyl)-2-mercapto-7-methyl-
SpectraBase Compound ID Hm6Q6U86pOW
InChI InChI=1S/C21H23F2N3O3S/c1-4-28-15-7-6-13(11-16(15)29-5-2)8-9-26-19-17(20(27)25-21(26)30)14(18(22)23)10-12(3)24-19/h6-7,10-11,18H,4-5,8-9H2,1-3H3,(H,25,27,30)
InChIKey PPBRKCAOJXBWTB-UHFFFAOYSA-N
Mol Weight 435.49 g/mol
Molecular Formula C21H23F2N3O3S
Exact Mass 435.142819 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 1IHZ9XawJvP
Name pyrido[2,3-d]pyrimidin-4(1H)-one, 1-[2-(3,4-diethoxyphenyl)ethyl]-5-(difluoromethyl)-2-mercapto-7-methyl-
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/C21H23F2N3O3S/c1-4-28-15-7-6-13(11-16(15)29-5-2)8-9-26-19-17(20(27)25-21(26)30)14(18(22)23)10-12(3)24-19/h6-7,10-11,18H,4-5,8-9H2,1-3H3,(H,25,27,30)
InChIKey PPBRKCAOJXBWTB-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_23751
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: 2283978; UZI_ID: UZI-023759
Temperature 308 °C