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5-ethyl-5-hexyl-2-phenyl-1,2,4-triazolidine-3-thione

View entire compound with spectra: 1 NMR

5-ethyl-5-hexyl-2-phenyl-1,2,4-triazolidine-3-thione
SpectraBase Compound ID GySBYFdgsBf
InChI InChI=1S/C16H25N3S/c1-3-5-6-10-13-16(4-2)17-15(20)19(18-16)14-11-8-7-9-12-14/h7-9,11-12,18H,3-6,10,13H2,1-2H3,(H,17,20)
InChIKey CBYSSFMMQHOZIL-UHFFFAOYSA-N
Mol Weight 291.46 g/mol
Molecular Formula C16H25N3S
Exact Mass 291.176919 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID BafT2ephl76
Name 5-ethyl-5-hexyl-2-phenyl-1,2,4-triazolidine-3-thione
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/C16H25N3S/c1-3-5-6-10-13-16(4-2)17-15(20)19(18-16)14-11-8-7-9-12-14/h7-9,11-12,18H,3-6,10,13H2,1-2H3,(H,17,20)
InChIKey CBYSSFMMQHOZIL-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_5153
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: 9680705; UBI_ID: UBI-005155
Temperature 318 °C