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2-{[3-(9-decenyl)-1H-1,2,4-triazol-5-yl]sulfanyl}-1-phenylethanone

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2-{[3-(9-decenyl)-1H-1,2,4-triazol-5-yl]sulfanyl}-1-phenylethanone
SpectraBase Compound ID BTqhplr6awc
InChI InChI=1S/C20H27N3OS/c1-2-3-4-5-6-7-8-12-15-19-21-20(23-22-19)25-16-18(24)17-13-10-9-11-14-17/h2,9-11,13-14H,1,3-8,12,15-16H2,(H,21,22,23)
InChIKey VHOJXFHUKFLDFB-UHFFFAOYSA-N
Mol Weight 357.52 g/mol
Molecular Formula C20H27N3OS
Exact Mass 357.187484 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID CdPTnpMmMhN
Name 2-{[3-(9-decenyl)-1H-1,2,4-triazol-5-yl]sulfanyl}-1-phenylethanone
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/C20H27N3OS/c1-2-3-4-5-6-7-8-12-15-19-21-20(23-22-19)25-16-18(24)17-13-10-9-11-14-17/h2,9-11,13-14H,1,3-8,12,15-16H2,(H,21,22,23)
InChIKey VHOJXFHUKFLDFB-UHFFFAOYSA-N
NMR Offset 14.9921
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_4877
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: 112569; Labnumber: AMIR-6022; VK_ID: VK-004880
Temperature 318 °C