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4-(4-sec-butylphenyl)-2-(3,5-dioxo-10-oxa-4-azatricyclo[5.2.1.0~2,6~]dec-4-yl)-5-methyl-3-thiophenecarbonitrile
SpectraBase Compound ID FHAuEpL00dx
InChI InChI=1S/C24H24N2O3S/c1-4-12(2)14-5-7-15(8-6-14)19-13(3)30-24(16(19)11-25)26-22(27)20-17-9-10-18(29-17)21(20)23(26)28/h5-8,12,17-18,20-21H,4,9-10H2,1-3H3/t12?,17-,18+,20-,21-/m0/s1
InChIKey OJTVFWALLWSIAH-NIHWBWJKSA-N
Mol Weight 420.53 g/mol
Molecular Formula C24H24N2O3S
Exact Mass 420.150764 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID FGmH7HeKwGf
Name 4-(4-sec-butylphenyl)-2-(3,5-dioxo-10-oxa-4-azatricyclo[5.2.1.0~2,6~]dec-4-yl)-5-methyl-3-thiophenecarbonitrile
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/C24H24N2O3S/c1-4-12(2)14-5-7-15(8-6-14)19-13(3)30-24(16(19)11-25)26-22(27)20-17-9-10-18(29-17)21(20)23(26)28/h5-8,12,17-18,20-21H,4,9-10H2,1-3H3/t12?,17-,18+,20-,21-/m0/s1
InChIKey OJTVFWALLWSIAH-NIHWBWJKSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_15799
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/1004284; Labnumber: NSB-0100203; UZI_ID: UZI-015803
Temperature 308 °C