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methyl 4-methyl-2-({[(4-methyl-6-phenyl-2-pyrimidinyl)sulfanyl]acetyl}amino)pentanoate
SpectraBase Compound ID BaftjBWC4mn
InChI InChI=1S/C20H25N3O3S/c1-13(2)10-17(19(25)26-4)22-18(24)12-27-20-21-14(3)11-16(23-20)15-8-6-5-7-9-15/h5-9,11,13,17H,10,12H2,1-4H3,(H,22,24)
InChIKey ULDXLOTXFKBYTG-UHFFFAOYSA-N
Mol Weight 387.5 g/mol
Molecular Formula C20H25N3O3S
Exact Mass 387.161663 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID DPPR9VialtD
Name methyl 4-methyl-2-({[(4-methyl-6-phenyl-2-pyrimidinyl)sulfanyl]acetyl}amino)pentanoate
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/C20H25N3O3S/c1-13(2)10-17(19(25)26-4)22-18(24)12-27-20-21-14(3)11-16(23-20)15-8-6-5-7-9-15/h5-9,11,13,17H,10,12H2,1-4H3,(H,22,24)
InChIKey ULDXLOTXFKBYTG-UHFFFAOYSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_7622
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: 9686437; UBI_ID: UBI-007625
Temperature 308 °C