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N-[1,1-bis(trifluoromethyl)propyl]-N'-[3-(1H-imidazol-1-yl)propyl]urea
SpectraBase Compound ID BdcdrWaZvnc
InChI InChI=1S/C12H16F6N4O/c1-2-10(11(13,14)15,12(16,17)18)21-9(23)20-4-3-6-22-7-5-19-8-22/h5,7-8H,2-4,6H2,1H3,(H2,20,21,23)
InChIKey UYRFUTPQASBVTJ-UHFFFAOYSA-N
Mol Weight 346.28 g/mol
Molecular Formula C12H16F6N4O
Exact Mass 346.12283 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID AnfpbZxmlmY
Name N-[1,1-bis(trifluoromethyl)propyl]-N'-[3-(1H-imidazol-1-yl)propyl]urea
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/C12H16F6N4O/c1-2-10(11(13,14)15,12(16,17)18)21-9(23)20-4-3-6-22-7-5-19-8-22/h5,7-8H,2-4,6H2,1H3,(H2,20,21,23)
InChIKey UYRFUTPQASBVTJ-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_5269
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: 62035; UBI_ID: UBI-005271
Temperature 308 °C