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2-{[3-(4-ethylphenoxy)-2-hydroxypropyl]sulfanyl}-4,6-diphenylnicotinonitrile
SpectraBase Compound ID FR6sWx9eSBx
InChI InChI=1S/C29H26N2O2S/c1-2-21-13-15-25(16-14-21)33-19-24(32)20-34-29-27(18-30)26(22-9-5-3-6-10-22)17-28(31-29)23-11-7-4-8-12-23/h3-17,24,32H,2,19-20H2,1H3
InChIKey PINGXXDSSHANCA-UHFFFAOYSA-N
Mol Weight 466.6 g/mol
Molecular Formula C29H26N2O2S
Exact Mass 466.171499 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID FO1nPyoNTVm
Name 2-{[3-(4-ethylphenoxy)-2-hydroxypropyl]sulfanyl}-4,6-diphenylnicotinonitrile
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/C29H26N2O2S/c1-2-21-13-15-25(16-14-21)33-19-24(32)20-34-29-27(18-30)26(22-9-5-3-6-10-22)17-28(31-29)23-11-7-4-8-12-23/h3-17,24,32H,2,19-20H2,1H3
InChIKey PINGXXDSSHANCA-UHFFFAOYSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_9125
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/9040283; UBI_ID: UBI-009128
Temperature 308 °C