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ethyl 2-[(1-adamantylcarbonyl)amino]-6-phenyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
SpectraBase Compound ID 2kz4vBrezmZ
InChI InChI=1S/C28H33NO3S/c1-2-32-26(30)24-22-9-8-21(20-6-4-3-5-7-20)13-23(22)33-25(24)29-27(31)28-14-17-10-18(15-28)12-19(11-17)16-28/h3-7,17-19,21H,2,8-16H2,1H3,(H,29,31)/t17-,18+,19-,21?,28-
InChIKey UDYCLKYENNBCOB-RJVDYUECSA-N
Mol Weight 463.6 g/mol
Molecular Formula C28H33NO3S
Exact Mass 463.218115 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID B5laoeCDEvK
Name ethyl 2-[(1-adamantylcarbonyl)amino]-6-phenyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
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/C28H33NO3S/c1-2-32-26(30)24-22-9-8-21(20-6-4-3-5-7-20)13-23(22)33-25(24)29-27(31)28-14-17-10-18(15-28)12-19(11-17)16-28/h3-7,17-19,21H,2,8-16H2,1H3,(H,29,31)/t17-,18+,19-,21?,28-
InChIKey UDYCLKYENNBCOB-RJVDYUECSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_20605
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/9149164; Labnumber: U_AM_ACK/054158; UZI_ID: UZI-020613
Temperature 318 °C