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3-[(2,3-dimethylphenoxy)methyl]-4-methoxybenzaldehyde N-allylthiosemicarbazone
SpectraBase Compound ID EnBcOVRq75r
InChI InChI=1S/C21H25N3O2S/c1-5-11-22-21(27)24-23-13-17-9-10-20(25-4)18(12-17)14-26-19-8-6-7-15(2)16(19)3/h5-10,12-13H,1,11,14H2,2-4H3,(H2,22,24,27)/b23-13+
InChIKey OLBARJBMAUFFAS-YDZHTSKRSA-N
Mol Weight 383.51 g/mol
Molecular Formula C21H25N3O2S
Exact Mass 383.166748 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID D2snGAwiPNc
Name 3-[(2,3-dimethylphenoxy)methyl]-4-methoxybenzaldehyde N-allylthiosemicarbazone
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/C21H25N3O2S/c1-5-11-22-21(27)24-23-13-17-9-10-20(25-4)18(12-17)14-26-19-8-6-7-15(2)16(19)3/h5-10,12-13H,1,11,14H2,2-4H3,(H2,22,24,27)/b23-13+
InChIKey OLBARJBMAUFFAS-YDZHTSKRSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_26690
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: D63834; Labnumber: KHAN-0584; SBI_ID: SBI-026694
Temperature 315 °C