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5-(2-Chlorophenyl)-2-(1,4-dioxa-8-azaspiro[4.5]dec-8-ylmethyl)-4-phenyl-2,4-dihydro-3H-1,2,4-triazole-3-thione
SpectraBase Compound ID FyERoFEwuVG
InChI InChI=1S/C22H23ClN4O2S/c23-19-9-5-4-8-18(19)20-24-26(21(30)27(20)17-6-2-1-3-7-17)16-25-12-10-22(11-13-25)28-14-15-29-22/h1-9H,10-16H2
InChIKey GFQYKOWVEJCBAK-UHFFFAOYSA-N
Mol Weight 442.97 g/mol
Molecular Formula C22H23ClN4O2S
Exact Mass 442.123025 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID KihSYmFANhB
Name 3H-1,2,4-triazole-3-thione, 5-(2-chlorophenyl)-2-(1,4-dioxa-8-azaspiro[4.5]dec-8-ylmethyl)-2,4-dihydro-4-phenyl-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 442.123024869 u
Formula C22H23ClN4O2S
InChI InChI=1S/C22H23ClN4O2S/c23-19-9-5-4-8-18(19)20-24-26(21(30)27(20)17-6-2-1-3-7-17)16-25-12-10-22(11-13-25)28-14-15-29-22/h1-9H,10-16H2
InChIKey GFQYKOWVEJCBAK-UHFFFAOYSA-N
Molecular Weight 442.965 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_7185
Solvent DMSO-d6
Source Vendor ID: NMR/10222344; Lab Info: LP; Lab Number: LP-2100161