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4-[4-(3-fluoro-4-methoxybenzyl)-1-piperazinyl]-N-(5-isopropyl-1,3,4-thiadiazol-2-yl)-4-oxobutanamide
SpectraBase Compound ID EtqWwrfM6lR
InChI InChI=1S/C21H28FN5O3S/c1-14(2)20-24-25-21(31-20)23-18(28)6-7-19(29)27-10-8-26(9-11-27)13-15-4-5-17(30-3)16(22)12-15/h4-5,12,14H,6-11,13H2,1-3H3,(H,23,25,28)
InChIKey CLRFDGCRONTZDM-UHFFFAOYSA-N
Mol Weight 449.55 g/mol
Molecular Formula C21H28FN5O3S
Exact Mass 449.189689 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 85DyJwKICJ6
Name 4-[4-(3-fluoro-4-methoxybenzyl)-1-piperazinyl]-N-(5-isopropyl-1,3,4-thiadiazol-2-yl)-4-oxobutanamide
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/C21H28FN5O3S/c1-14(2)20-24-25-21(31-20)23-18(28)6-7-19(29)27-10-8-26(9-11-27)13-15-4-5-17(30-3)16(22)12-15/h4-5,12,14H,6-11,13H2,1-3H3,(H,23,25,28)
InChIKey CLRFDGCRONTZDM-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_29412
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: D92780; Labnumber: GRESKO-7450; SBI_ID: SBI-029416
Temperature 318 °C