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ethyl 2-[(1-adamantylacetyl)amino]-4-(4-butylphenyl)-5-methyl-3-thiophenecarboxylate
SpectraBase Compound ID 1XHhkM3uPsm
InChI InChI=1S/C30H39NO3S/c1-4-6-7-20-8-10-24(11-9-20)26-19(3)35-28(27(26)29(33)34-5-2)31-25(32)18-30-15-21-12-22(16-30)14-23(13-21)17-30/h8-11,21-23H,4-7,12-18H2,1-3H3,(H,31,32)/t21-,22+,23-,30-
InChIKey MZNLSHXNNFPMND-XEKWSLBJSA-N
Mol Weight 493.7 g/mol
Molecular Formula C30H39NO3S
Exact Mass 493.265065 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID K4HSgU6Jsp1
Name ethyl 2-[(1-adamantylacetyl)amino]-4-(4-butylphenyl)-5-methyl-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/C30H39NO3S/c1-4-6-7-20-8-10-24(11-9-20)26-19(3)35-28(27(26)29(33)34-5-2)31-25(32)18-30-15-21-12-22(16-30)14-23(13-21)17-30/h8-11,21-23H,4-7,12-18H2,1-3H3,(H,31,32)/t21-,22+,23-,30-
InChIKey MZNLSHXNNFPMND-XEKWSLBJSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_20510
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/9227658; Labnumber: U_AM_ACK/047075; UZI_ID: UZI-020518
Temperature 308 °C