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methyl 4-({[(5-ethyl-4-hydroxy-6-methyl-2-pyrimidinyl)sulfanyl]acetyl}amino)benzoate
SpectraBase Compound ID KyFp82MurL1
InChI InChI=1S/C17H19N3O4S/c1-4-13-10(2)18-17(20-15(13)22)25-9-14(21)19-12-7-5-11(6-8-12)16(23)24-3/h5-8H,4,9H2,1-3H3,(H,19,21)(H,18,20,22)
InChIKey XBHGJZMBZYNPAV-UHFFFAOYSA-N
Mol Weight 361.42 g/mol
Molecular Formula C17H19N3O4S
Exact Mass 361.109627 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 78VpvUlLo4i
Name methyl 4-({[(5-ethyl-4-hydroxy-6-methyl-2-pyrimidinyl)sulfanyl]acetyl}amino)benzoate
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/C17H19N3O4S/c1-4-13-10(2)18-17(20-15(13)22)25-9-14(21)19-12-7-5-11(6-8-12)16(23)24-3/h5-8H,4,9H2,1-3H3,(H,19,21)(H,18,20,22)
InChIKey XBHGJZMBZYNPAV-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_3263
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: D09812; Labnumber: NNOBK-5243; SBI_ID: SBI-003265
Temperature 315 °C