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3-(butylsulfanyl)[1,2,4]triazolo[3,4-b][1,3]benzothiazole
SpectraBase Compound ID K8Er6vrHy8P
InChI InChI=1S/C12H13N3S2/c1-2-3-8-16-11-13-14-12-15(11)9-6-4-5-7-10(9)17-12/h4-7H,2-3,8H2,1H3
InChIKey JJMOUYPQUNZHQG-UHFFFAOYSA-N
Mol Weight 263.38 g/mol
Molecular Formula C12H13N3S2
Exact Mass 263.05509 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID EbKbv2fITTI
Name 3-(butylsulfanyl)[1,2,4]triazolo[3,4-b][1,3]benzothiazole
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/C12H13N3S2/c1-2-3-8-16-11-13-14-12-15(11)9-6-4-5-7-10(9)17-12/h4-7H,2-3,8H2,1H3
InChIKey JJMOUYPQUNZHQG-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_1804
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: 701179EX00072723; Labnumber: 701179EX00072723; VK_ID: VK-001805
Synonyms butyl [1,2,4]triazolo[3,4-b][1,3]benzothiazol-3-yl sulfide
Temperature 318 °C