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3-[(4-chloro-2-isopropyl-5-methylphenoxy)methyl]-4-methoxybenzaldehyde N-ethylthiosemicarbazone
SpectraBase Compound ID GXDRmuKQd2f
InChI InChI=1S/C22H28ClN3O2S/c1-6-24-22(29)26-25-12-16-7-8-20(27-5)17(10-16)13-28-21-9-15(4)19(23)11-18(21)14(2)3/h7-12,14H,6,13H2,1-5H3,(H2,24,26,29)/b25-12+
InChIKey YNCOTJWNYLPTGX-BRJLIKDPSA-N
Mol Weight 434.0 g/mol
Molecular Formula C22H28ClN3O2S
Exact Mass 433.159076 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID BzqLhZ3OosJ
Name 3-[(4-chloro-2-isopropyl-5-methylphenoxy)methyl]-4-methoxybenzaldehyde N-ethylthiosemicarbazone
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/C22H28ClN3O2S/c1-6-24-22(29)26-25-12-16-7-8-20(27-5)17(10-16)13-28-21-9-15(4)19(23)11-18(21)14(2)3/h7-12,14H,6,13H2,1-5H3,(H2,24,26,29)/b25-12+
InChIKey YNCOTJWNYLPTGX-BRJLIKDPSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_18737
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: D10003; Labnumber: KHAN-0624; SBI_ID: SBI-018740
Temperature 308 °C