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3-(9-decenyl)-5-(hexadecylsulfanyl)-1H-1,2,4-triazole
SpectraBase Compound ID JwupIdonEV2
InChI InChI=1S/C28H53N3S/c1-3-5-7-9-11-13-14-15-16-17-18-20-22-24-26-32-28-29-27(30-31-28)25-23-21-19-12-10-8-6-4-2/h4H,2-3,5-26H2,1H3,(H,29,30,31)
InChIKey NHAOMLJVGNBQCP-UHFFFAOYSA-N
Mol Weight 463.8 g/mol
Molecular Formula C28H53N3S
Exact Mass 463.39602 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID EQMVnmFrwlu
Name 3-(9-decenyl)-5-(hexadecylsulfanyl)-1H-1,2,4-triazole
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/C28H53N3S/c1-3-5-7-9-11-13-14-15-16-17-18-20-22-24-26-32-28-29-27(30-31-28)25-23-21-19-12-10-8-6-4-2/h4H,2-3,5-26H2,1H3,(H,29,30,31)
InChIKey NHAOMLJVGNBQCP-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_4874
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: 112566; Labnumber: AMIR-6019; VK_ID: VK-004877
Synonyms 3-(9-decenyl)-1H-1,2,4-triazol-5-yl hexadecyl sulfide
Temperature 308 °C