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methyl 2-{[(mesityloxy)acetyl]amino}-6-phenyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
SpectraBase Compound ID CEOWfzI2dWf
InChI InChI=1S/C27H29NO4S/c1-16-12-17(2)25(18(3)13-16)32-15-23(29)28-26-24(27(30)31-4)21-11-10-20(14-22(21)33-26)19-8-6-5-7-9-19/h5-9,12-13,20H,10-11,14-15H2,1-4H3,(H,28,29)
InChIKey RJAYHVSAFXYWDN-UHFFFAOYSA-N
Mol Weight 463.59 g/mol
Molecular Formula C27H29NO4S
Exact Mass 463.18173 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID De2M0ooEhLL
Name methyl 2-{[(mesityloxy)acetyl]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/C27H29NO4S/c1-16-12-17(2)25(18(3)13-16)32-15-23(29)28-26-24(27(30)31-4)21-11-10-20(14-22(21)33-26)19-8-6-5-7-9-19/h5-9,12-13,20H,10-11,14-15H2,1-4H3,(H,28,29)
InChIKey RJAYHVSAFXYWDN-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_8937
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: 1001093; UBI_ID: UBI-008940
Temperature 318 °C