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object
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_id
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CCEFEy9ZAqx
spectrumID
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CCEFEy9ZAqx
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NY2X:149576:1
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analyticalTechnique
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1H NMR
analyticalTechniqueLongName
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1H Nuclear Magnetic Resonance (NMR) Spectrum
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2-amino-4-{4-[(2-chlorophenoxy)methyl]-5-ethyl-2-thienyl}-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridine-3-carbonitrile
SpectraBase Compound ID 1wfYj0ohEXB
InChI InChI=1S/C24H24ClN3OS/c1-2-21-15(14-29-20-11-7-6-9-18(20)25)12-22(30-21)23-16-8-4-3-5-10-19(16)28-24(27)17(23)13-26/h6-7,9,11-12H,2-5,8,10,14H2,1H3,(H2,27,28)
InChIKey LBUHSGWMJTYWMN-UHFFFAOYSA-N
Mol Weight 437.99 g/mol
Molecular Formula C24H24ClN3OS
Exact Mass 437.132861 g/mol
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1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID CCEFEy9ZAqx
Name 2-amino-4-{4-[(2-chlorophenoxy)methyl]-5-ethyl-2-thienyl}-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridine-3-carbonitrile
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2025 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2025 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C24H24ClN3OS/c1-2-21-15(14-29-20-11-7-6-9-18(20)25)12-22(30-21)23-16-8-4-3-5-10-19(16)28-24(27)17(23)13-26/h6-7,9,11-12H,2-5,8,10,14H2,1H3,(H2,27,28)
InChIKey LBUHSGWMJTYWMN-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_18285
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/1031458; Labnumber: TSI4017; UZI_ID: UZI-018292
Temperature 318 °C
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