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ethyl 6-tert-butyl-2-({[5-phenyl-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidin-2-yl]carbonyl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
SpectraBase Compound ID 70dN8jzztE2
InChI InChI=1S/C29H33F3N4O3S/c1-5-39-27(38)24-18-12-11-17(28(2,3)4)13-21(18)40-26(24)34-25(37)20-15-23-33-19(16-9-7-6-8-10-16)14-22(29(30,31)32)36(23)35-20/h6-10,15,17,19,22,33H,5,11-14H2,1-4H3,(H,34,37)
InChIKey DWCVDVFJSKTADA-UHFFFAOYSA-N
Mol Weight 574.7 g/mol
Molecular Formula C29H33F3N4O3S
Exact Mass 574.222547 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID APJWO3seX2m
Name ethyl 6-tert-butyl-2-({[5-phenyl-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidin-2-yl]carbonyl}amino)-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/C29H33F3N4O3S/c1-5-39-27(38)24-18-12-11-17(28(2,3)4)13-21(18)40-26(24)34-25(37)20-15-23-33-19(16-9-7-6-8-10-16)14-22(29(30,31)32)36(23)35-20/h6-10,15,17,19,22,33H,5,11-14H2,1-4H3,(H,34,37)
InChIKey DWCVDVFJSKTADA-UHFFFAOYSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_11653
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent ACETONE-d6
Source File Reference VendorID: UZI/9098802; UBI_ID: UBI-011656
Temperature 308 °C