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2,2,2-trifluoroethyl 5-{[4-(1-adamantyl)-1,3-thiazol-2-yl]amino}-5-oxopentanoate
SpectraBase Compound ID L0mbjIRviVQ
InChI InChI=1S/C20H25F3N2O3S/c21-20(22,23)11-28-17(27)3-1-2-16(26)25-18-24-15(10-29-18)19-7-12-4-13(8-19)6-14(5-12)9-19/h10,12-14H,1-9,11H2,(H,24,25,26)/t12-,13+,14-,19-
InChIKey UNMDINYQRCXPKW-KRFSREQESA-N
Mol Weight 430.49 g/mol
Molecular Formula C20H25F3N2O3S
Exact Mass 430.153798 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 5wYXHqrRM7l
Name 2,2,2-trifluoroethyl 5-{[4-(1-adamantyl)-1,3-thiazol-2-yl]amino}-5-oxopentanoate
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/C20H25F3N2O3S/c21-20(22,23)11-28-17(27)3-1-2-16(26)25-18-24-15(10-29-18)19-7-12-4-13(8-19)6-14(5-12)9-19/h10,12-14H,1-9,11H2,(H,24,25,26)/t12-,13+,14-,19-
InChIKey UNMDINYQRCXPKW-KRFSREQESA-N
NMR Offset 16.0772
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_9538
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/9046421; UBI_ID: UBI-009541
Temperature 308 °C