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5-allyl-3-[(2-phenylethyl)sulfanyl]-5H-[1,2,4]triazino[5,6-b]indole
SpectraBase Compound ID 6wGcFTSby7s
InChI InChI=1S/C20H18N4S/c1-2-13-24-17-11-7-6-10-16(17)18-19(24)21-20(23-22-18)25-14-12-15-8-4-3-5-9-15/h2-11H,1,12-14H2
InChIKey UGXNADUNNPJQDD-UHFFFAOYSA-N
Mol Weight 346.45 g/mol
Molecular Formula C20H18N4S
Exact Mass 346.125218 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID CiuS3DFfmV2
Name 5-allyl-3-[(2-phenylethyl)sulfanyl]-5H-[1,2,4]triazino[5,6-b]indole
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/C20H18N4S/c1-2-13-24-17-11-7-6-10-16(17)18-19(24)21-20(23-22-18)25-14-12-15-8-4-3-5-9-15/h2-11H,1,12-14H2
InChIKey UGXNADUNNPJQDD-UHFFFAOYSA-N
NMR Offset 15.0036
NMR Spectrometer Frequency 250.134
Observed nucleus 1H
Origin 1H_ASIOH_7529_263
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: ZI/8159331; Labnumber: L-23/0006296
Temperature 297 °C