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N-(4-chloro-3-nitrophenyl)-2-({5-[4-(difluoromethoxy)phenyl]-4-ethyl-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide
SpectraBase Compound ID 6EiamP7gRq7
InChI InChI=1S/C19H16ClF2N5O4S/c1-2-26-17(11-3-6-13(7-4-11)31-18(21)22)24-25-19(26)32-10-16(28)23-12-5-8-14(20)15(9-12)27(29)30/h3-9,18H,2,10H2,1H3,(H,23,28)
InChIKey HTBXWLSCMCYKQE-UHFFFAOYSA-N
Mol Weight 483.88 g/mol
Molecular Formula C19H16ClF2N5O4S
Exact Mass 483.057959 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID IFl9Kmomf5E
Name N-(4-chloro-3-nitrophenyl)-2-({5-[4-(difluoromethoxy)phenyl]-4-ethyl-4H-1,2,4-triazol-3-yl}sulfanyl)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/C19H16ClF2N5O4S/c1-2-26-17(11-3-6-13(7-4-11)31-18(21)22)24-25-19(26)32-10-16(28)23-12-5-8-14(20)15(9-12)27(29)30/h3-9,18H,2,10H2,1H3,(H,23,28)
InChIKey HTBXWLSCMCYKQE-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_6700
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/1265294; Labnumber: COL3262; UZI_ID: UZI-006702
Temperature 318 °C