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3-(ethylsulfanyl)-6-(3-thienyl)-6,7-dihydro[1,2,4]triazino[5,6-d][3,1]benzoxazepine
SpectraBase Compound ID 1NlLSCDt8Rt
InChI InChI=1S/C16H14N4OS2/c1-2-23-16-18-15-13(19-20-16)11-5-3-4-6-12(11)17-14(21-15)10-7-8-22-9-10/h3-9,14,17H,2H2,1H3
InChIKey YUFPTFHRNMWWQN-UHFFFAOYSA-N
Mol Weight 342.44 g/mol
Molecular Formula C16H14N4OS2
Exact Mass 342.060903 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID LY17aYMDSYL
Name 3-(ethylsulfanyl)-6-(3-thienyl)-6,7-dihydro[1,2,4]triazino[5,6-d][3,1]benzoxazepine
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/C16H14N4OS2/c1-2-23-16-18-15-13(19-20-16)11-5-3-4-6-12(11)17-14(21-15)10-7-8-22-9-10/h3-9,14,17H,2H2,1H3
InChIKey YUFPTFHRNMWWQN-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_2841
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: UZI/8065793; UBI_ID: UBI-002842
Synonyms ethyl 6-(3-thienyl)-6,7-dihydro[1,2,4]triazino[5,6-d][3,1]benzoxazepin-3-yl sulfide
Temperature 308 °C