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{4-chloro-2-[5-(ethoxycarbonyl)-6-propyl-2-thioxo-1,2,3,4-tetrahydro-4-pyrimidinyl]-6-methoxyphenoxy}acetic acid
SpectraBase Compound ID KKFXCPDiwvZ
InChI InChI=1S/C19H23ClN2O6S/c1-4-6-12-15(18(25)27-5-2)16(22-19(29)21-12)11-7-10(20)8-13(26-3)17(11)28-9-14(23)24/h7-8,16H,4-6,9H2,1-3H3,(H,23,24)(H2,21,22,29)
InChIKey BBCTUISNVOHJDS-UHFFFAOYSA-N
Mol Weight 442.91 g/mol
Molecular Formula C19H23ClN2O6S
Exact Mass 442.096535 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID DSd16X8tu7r
Name {4-chloro-2-[5-(ethoxycarbonyl)-6-propyl-2-thioxo-1,2,3,4-tetrahydro-4-pyrimidinyl]-6-methoxyphenoxy}acetic acid
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/C19H23ClN2O6S/c1-4-6-12-15(18(25)27-5-2)16(22-19(29)21-12)11-7-10(20)8-13(26-3)17(11)28-9-14(23)24/h7-8,16H,4-6,9H2,1-3H3,(H,23,24)(H2,21,22,29)
InChIKey BBCTUISNVOHJDS-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_32100
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: 1844580; SBI_ID: SBI-032104
Temperature 318 °C