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N-{5-[(4-chlorophenoxy)methyl]-1,3,4-thiadiazol-2-yl}-1-adamantanecarboxamide
SpectraBase Compound ID Bw2GbZbxoUe
InChI InChI=1S/C20H22ClN3O2S/c21-15-1-3-16(4-2-15)26-11-17-23-24-19(27-17)22-18(25)20-8-12-5-13(9-20)7-14(6-12)10-20/h1-4,12-14H,5-11H2,(H,22,24,25)/t12-,13+,14-,20-
InChIKey BCIALMXZWPZDLS-OYEQCZOJSA-N
Mol Weight 403.93 g/mol
Molecular Formula C20H22ClN3O2S
Exact Mass 403.112126 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Hw58DPCGp9A
Name N-{5-[(4-chlorophenoxy)methyl]-1,3,4-thiadiazol-2-yl}-1-adamantanecarboxamide
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/C20H22ClN3O2S/c21-15-1-3-16(4-2-15)26-11-17-23-24-19(27-17)22-18(25)20-8-12-5-13(9-20)7-14(6-12)10-20/h1-4,12-14H,5-11H2,(H,22,24,25)/t12-,13+,14-,20-
InChIKey BCIALMXZWPZDLS-OYEQCZOJSA-N
NMR Offset 15.0036
NMR Spectrometer Frequency 250.134
Observed nucleus 1H
Origin 1H_ASIOH_7529_1600
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: ZI/7115877; Labnumber: CEP-1980352
Temperature 297 °C