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6-[2-(benzyloxy)phenyl]-3-(methylsulfanyl)-6,7-dihydro[1,2,4]triazino[5,6-d][3,1]benzoxazepine
SpectraBase Compound ID EMzOgKad4AM
InChI InChI=1S/C24H20N4O2S/c1-31-24-26-23-21(27-28-24)17-11-5-7-13-19(17)25-22(30-23)18-12-6-8-14-20(18)29-15-16-9-3-2-4-10-16/h2-14,22,25H,15H2,1H3
InChIKey AJAYLZHLEPQHOI-UHFFFAOYSA-N
Mol Weight 428.51 g/mol
Molecular Formula C24H20N4O2S
Exact Mass 428.130697 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 1wdl86lw6hR
Name 6-[2-(benzyloxy)phenyl]-3-(methylsulfanyl)-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/C24H20N4O2S/c1-31-24-26-23-21(27-28-24)17-11-5-7-13-19(17)25-22(30-23)18-12-6-8-14-20(18)29-15-16-9-3-2-4-10-16/h2-14,22,25H,15H2,1H3
InChIKey AJAYLZHLEPQHOI-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_16472
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/8121996; UBI_ID: UBI-016475
Synonyms benzyl 2-[3-(methylsulfanyl)-6,7-dihydro[1,2,4]triazino[5,6-d][3,1]benzoxazepin-6-yl]phenyl ether
Temperature 318 °C