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methyl {[5-(2,4-dichlorophenyl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetate
SpectraBase Compound ID IYJN8Uc74tL
InChI InChI=1S/C13H13Cl2N3O2S/c1-3-18-12(9-5-4-8(14)6-10(9)15)16-17-13(18)21-7-11(19)20-2/h4-6H,3,7H2,1-2H3
InChIKey SEYSTSSXEBESBK-UHFFFAOYSA-N
Mol Weight 346.23 g/mol
Molecular Formula C13H13Cl2N3O2S
Exact Mass 345.010553 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID KdR2U4Nkfhf
Name methyl {[5-(2,4-dichlorophenyl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetate
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/C13H13Cl2N3O2S/c1-3-18-12(9-5-4-8(14)6-10(9)15)16-17-13(18)21-7-11(19)20-2/h4-6H,3,7H2,1-2H3
InChIKey SEYSTSSXEBESBK-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_8187
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: D33059; Labnumber: SPUL-1853; SBI_ID: SBI-008190
Temperature 308 °C