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ethyl 2-[(1-adamantylacetyl)amino]-5-methyl-4-phenyl-3-thiophenecarboxylate
SpectraBase Compound ID JmCXZX4SYfB
InChI InChI=1S/C26H31NO3S/c1-3-30-25(29)23-22(20-7-5-4-6-8-20)16(2)31-24(23)27-21(28)15-26-12-17-9-18(13-26)11-19(10-17)14-26/h4-8,17-19H,3,9-15H2,1-2H3,(H,27,28)/t17-,18+,19-,26-
InChIKey JDRYTHMAHMFNIP-MCTDJQMZSA-N
Mol Weight 437.6 g/mol
Molecular Formula C26H31NO3S
Exact Mass 437.202465 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID BkqIJHPfF0j
Name ethyl 2-[(1-adamantylacetyl)amino]-5-methyl-4-phenyl-3-thiophenecarboxylate
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/C26H31NO3S/c1-3-30-25(29)23-22(20-7-5-4-6-8-20)16(2)31-24(23)27-21(28)15-26-12-17-9-18(13-26)11-19(10-17)14-26/h4-8,17-19H,3,9-15H2,1-2H3,(H,27,28)/t17-,18+,19-,26-
InChIKey JDRYTHMAHMFNIP-MCTDJQMZSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_20471
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/9200613; Labnumber: U_AM_ACK/045689; UZI_ID: UZI-020479
Temperature 308 °C