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ethyl [({[5-(4-chlorophenyl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]acetate
SpectraBase Compound ID 1e4bl8uHTiy
InChI InChI=1S/C16H19ClN4O3S/c1-3-21-15(11-5-7-12(17)8-6-11)19-20-16(21)25-10-13(22)18-9-14(23)24-4-2/h5-8H,3-4,9-10H2,1-2H3,(H,18,22)
InChIKey OZMNFSSKNOUPPI-UHFFFAOYSA-N
Mol Weight 382.87 g/mol
Molecular Formula C16H19ClN4O3S
Exact Mass 382.086639 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID F3LrPD6GLr7
Name ethyl [({[5-(4-chlorophenyl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]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/C16H19ClN4O3S/c1-3-21-15(11-5-7-12(17)8-6-11)19-20-16(21)25-10-13(22)18-9-14(23)24-4-2/h5-8H,3-4,9-10H2,1-2H3,(H,18,22)
InChIKey OZMNFSSKNOUPPI-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_11720
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: E08653; Labnumber: GRES-37314; SBI_ID: SBI-011723
Temperature 308 °C