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acetamide, N-(5-methyl-3-isoxazolyl)-2-[[4-methyl-5-(phenylmethyl)-4H-1,2,4-triazol-3-yl]thio]-
SpectraBase Compound ID GtbBZxmWYV2
InChI InChI=1S/C16H17N5O2S/c1-11-8-13(20-23-11)17-15(22)10-24-16-19-18-14(21(16)2)9-12-6-4-3-5-7-12/h3-8H,9-10H2,1-2H3,(H,17,20,22)
InChIKey IIUIHKFTRMVLJJ-UHFFFAOYSA-N
Mol Weight 343.41 g/mol
Molecular Formula C16H17N5O2S
Exact Mass 343.110296 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID AJFmRDGLIUs
Name acetamide, N-(5-methyl-3-isoxazolyl)-2-[[4-methyl-5-(phenylmethyl)-4H-1,2,4-triazol-3-yl]thio]-
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2025 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2025 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C16H17N5O2S/c1-11-8-13(20-23-11)17-15(22)10-24-16-19-18-14(21(16)2)9-12-6-4-3-5-7-12/h3-8H,9-10H2,1-2H3,(H,17,20,22)
InChIKey IIUIHKFTRMVLJJ-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_11628_10208
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: F36813; Labnumber: YAKV-42937
Temperature 315 °C