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N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-{[5-(2-fluorophenyl)-4-(2-furylmethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
SpectraBase Compound ID Hd7pNkujkfY
InChI InChI=1S/C23H19FN4O4S/c24-18-6-2-1-5-17(18)22-26-27-23(28(22)13-16-4-3-9-30-16)33-14-21(29)25-15-7-8-19-20(12-15)32-11-10-31-19/h1-9,12H,10-11,13-14H2,(H,25,29)
InChIKey OOYFJXHYIMWJNH-UHFFFAOYSA-N
Mol Weight 466.49 g/mol
Molecular Formula C23H19FN4O4S
Exact Mass 466.111104 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 3S9tCdmJzvS
Name N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-{[5-(2-fluorophenyl)-4-(2-furylmethyl)-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/C23H19FN4O4S/c24-18-6-2-1-5-17(18)22-26-27-23(28(22)13-16-4-3-9-30-16)33-14-21(29)25-15-7-8-19-20(12-15)32-11-10-31-19/h1-9,12H,10-11,13-14H2,(H,25,29)
InChIKey OOYFJXHYIMWJNH-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_11336
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: E06644; Labnumber: GRES-26673; SBI_ID: SBI-011339
Temperature 308 °C