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4-(4-allyl-5-sulfanyl-4H-1,2,4-triazol-3-yl)-2-octanol

View entire compound with spectra: 1 NMR

4-(4-allyl-5-sulfanyl-4H-1,2,4-triazol-3-yl)-2-octanol
SpectraBase Compound ID 82GvQlXQC0j
InChI InChI=1S/C13H23N3OS/c1-4-6-7-11(9-10(3)17)12-14-15-13(18)16(12)8-5-2/h5,10-11,17H,2,4,6-9H2,1,3H3,(H,15,18)
InChIKey QMSQBJMZVDKFJC-UHFFFAOYSA-N
Mol Weight 269.41 g/mol
Molecular Formula C13H23N3OS
Exact Mass 269.156184 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID BIY4vG1yEXX
Name 4-(4-allyl-5-sulfanyl-4H-1,2,4-triazol-3-yl)-2-octanol
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/C13H23N3OS/c1-4-6-7-11(9-10(3)17)12-14-15-13(18)16(12)8-5-2/h5,10-11,17H,2,4,6-9H2,1,3H3,(H,15,18)
InChIKey QMSQBJMZVDKFJC-UHFFFAOYSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_4227
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: 112305; Labnumber: AMIR-4889; VK_ID: VK-004228
Temperature 308 °C