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2-({5-[4-(difluoromethoxy)phenyl]-4-ethyl-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(3-nitrophenyl)acetamide
SpectraBase Compound ID 851HYjmLYLX
InChI InChI=1S/C19H17F2N5O4S/c1-2-25-17(12-6-8-15(9-7-12)30-18(20)21)23-24-19(25)31-11-16(27)22-13-4-3-5-14(10-13)26(28)29/h3-10,18H,2,11H2,1H3,(H,22,27)
InChIKey UPSCFIBNSZSFRR-UHFFFAOYSA-N
Mol Weight 449.43 g/mol
Molecular Formula C19H17F2N5O4S
Exact Mass 449.096932 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID H9Ir1Kaz0Ay
Name 2-({5-[4-(difluoromethoxy)phenyl]-4-ethyl-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(3-nitrophenyl)acetamide
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/C19H17F2N5O4S/c1-2-25-17(12-6-8-15(9-7-12)30-18(20)21)23-24-19(25)31-11-16(27)22-13-4-3-5-14(10-13)26(28)29/h3-10,18H,2,11H2,1H3,(H,22,27)
InChIKey UPSCFIBNSZSFRR-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_6780
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: UZI/1266541; Labnumber: COL3415; UZI_ID: UZI-006782
Temperature 318 °C