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O,O-diethyl 5-benzoyl-3-cyano-4-phenyl-2-thienylamidothiophosphate
SpectraBase Compound ID 6Hkl11Mc8RG
InChI InChI=1S/C22H21N2O3PS2/c1-3-26-28(29,27-4-2)24-22-18(15-23)19(16-11-7-5-8-12-16)21(30-22)20(25)17-13-9-6-10-14-17/h5-14H,3-4H2,1-2H3,(H,24,29)
InChIKey IIRGTMVAJREWNM-UHFFFAOYSA-N
Mol Weight 456.51 g/mol
Molecular Formula C22H21N2O3PS2
Exact Mass 456.073122 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID A4gl2GKxri2
Name O,O-diethyl 5-benzoyl-3-cyano-4-phenyl-2-thienylamidothiophosphate
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/C22H21N2O3PS2/c1-3-26-28(29,27-4-2)24-22-18(15-23)19(16-11-7-5-8-12-16)21(30-22)20(25)17-13-9-6-10-14-17/h5-14H,3-4H2,1-2H3,(H,24,29)
InChIKey IIRGTMVAJREWNM-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_20769
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: S16140; Labnumber: TTT-0494; SBI_ID: SBI-020773
Temperature 315 °C