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3-(butylsulfanyl)-6-(4-ethylphenyl)-6,7-dihydro[1,2,4]triazino[5,6-d][3,1]benzoxazepine
SpectraBase Compound ID FRKRYl8yBug
InChI InChI=1S/C22H24N4OS/c1-3-5-14-28-22-24-21-19(25-26-22)17-8-6-7-9-18(17)23-20(27-21)16-12-10-15(4-2)11-13-16/h6-13,20,23H,3-5,14H2,1-2H3
InChIKey VXJOVMOGNUBVEQ-UHFFFAOYSA-N
Mol Weight 392.52 g/mol
Molecular Formula C22H24N4OS
Exact Mass 392.167083 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID HMu1WDujC3C
Name 3-(butylsulfanyl)-6-(4-ethylphenyl)-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/C22H24N4OS/c1-3-5-14-28-22-24-21-19(25-26-22)17-8-6-7-9-18(17)23-20(27-21)16-12-10-15(4-2)11-13-16/h6-13,20,23H,3-5,14H2,1-2H3
InChIKey VXJOVMOGNUBVEQ-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_2990
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/8077228; UBI_ID: UBI-002991
Synonyms butyl 6-(4-ethylphenyl)-6,7-dihydro[1,2,4]triazino[5,6-d][3,1]benzoxazepin-3-yl sulfide
Temperature 308 °C