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4-[(Z)-(2-[4-(3-methylphenyl)-1-piperazinyl]-4-oxo-1,3-thiazol-5(4H)-ylidene)methyl]phenyl benzoate
SpectraBase Compound ID KDO9JaC1SSZ
InChI InChI=1S/C28H25N3O3S/c1-20-6-5-9-23(18-20)30-14-16-31(17-15-30)28-29-26(32)25(35-28)19-21-10-12-24(13-11-21)34-27(33)22-7-3-2-4-8-22/h2-13,18-19H,14-17H2,1H3/b25-19-
InChIKey ZRMMPDUAGAZJDA-PLRJNAJWSA-N
Mol Weight 483.59 g/mol
Molecular Formula C28H25N3O3S
Exact Mass 483.161663 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 7tvQsGO3ull
Name 4-[(Z)-(2-[4-(3-methylphenyl)-1-piperazinyl]-4-oxo-1,3-thiazol-5(4H)-ylidene)methyl]phenyl benzoate
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/C28H25N3O3S/c1-20-6-5-9-23(18-20)30-14-16-31(17-15-30)28-29-26(32)25(35-28)19-21-10-12-24(13-11-21)34-27(33)22-7-3-2-4-8-22/h2-13,18-19H,14-17H2,1H3/b25-19-
InChIKey ZRMMPDUAGAZJDA-PLRJNAJWSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_10973
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: E03589; Labnumber: EX00112994; SBI_ID: SBI-010976
Synonyms 4-[(2-[4-(3-methylphenyl)-1-piperazinyl]-4-oxo-1,3-thiazol-5(4H)-ylidene)methyl]phenyl benzoate
Temperature 315 °C