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4-methylbenzyl 5H-[1,2,4]triazino[5,6-b]indol-3-yl sulfide

View entire compound with spectra: 1 NMR

4-methylbenzyl 5H-[1,2,4]triazino[5,6-b]indol-3-yl sulfide
SpectraBase Compound ID GMEhUjNFfES
InChI InChI=1S/C17H14N4S/c1-11-6-8-12(9-7-11)10-22-17-19-16-15(20-21-17)13-4-2-3-5-14(13)18-16/h2-9H,10H2,1H3,(H,18,19,21)
InChIKey CVFHIKAWXVSYQW-UHFFFAOYSA-N
Mol Weight 306.39 g/mol
Molecular Formula C17H14N4S
Exact Mass 306.093918 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 5vR1i6jUTXj
Name 4-methylbenzyl 5H-[1,2,4]triazino[5,6-b]indol-3-yl sulfide
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/C17H14N4S/c1-11-6-8-12(9-7-11)10-22-17-19-16-15(20-21-17)13-4-2-3-5-14(13)18-16/h2-9H,10H2,1H3,(H,18,19,21)
InChIKey CVFHIKAWXVSYQW-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_13732
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: 200682; Labnumber: SPYAK-138; VK_ID: VK-013737
Synonyms 3-[(4-methylbenzyl)sulfanyl]-5H-[1,2,4]triazino[5,6-b]indole
Temperature 318 °C