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ethyl 2-[(1-adamantylacetyl)amino]-4-ethyl-5-methyl-3-thiophenecarboxylate
SpectraBase Compound ID 4snF8MFUAFB
InChI InChI=1S/C22H31NO3S/c1-4-17-13(3)27-20(19(17)21(25)26-5-2)23-18(24)12-22-9-14-6-15(10-22)8-16(7-14)11-22/h14-16H,4-12H2,1-3H3,(H,23,24)/t14-,15+,16-,22-
InChIKey RBLMYYGQUIABQN-OFWUGVANSA-N
Mol Weight 389.55 g/mol
Molecular Formula C22H31NO3S
Exact Mass 389.202465 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 9zDplqCH63q
Name ethyl 2-[(1-adamantylacetyl)amino]-4-ethyl-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/C22H31NO3S/c1-4-17-13(3)27-20(19(17)21(25)26-5-2)23-18(24)12-22-9-14-6-15(10-22)8-16(7-14)11-22/h14-16H,4-12H2,1-3H3,(H,23,24)/t14-,15+,16-,22-
InChIKey RBLMYYGQUIABQN-OFWUGVANSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_20393
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/9163837; UBI_ID: UBI-020397
Temperature 318 °C