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N-(1-adamantyl)-N'-(2-chloro-4,5-difluorophenyl)-N-methylurea

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N-(1-adamantyl)-N'-(2-chloro-4,5-difluorophenyl)-N-methylurea
SpectraBase Compound ID 4hdwonFxoT1
InChI InChI=1S/C18H21ClF2N2O/c1-23(17(24)22-16-6-15(21)14(20)5-13(16)19)18-7-10-2-11(8-18)4-12(3-10)9-18/h5-6,10-12H,2-4,7-9H2,1H3,(H,22,24)/t10-,11+,12-,18-
InChIKey OCXRZJYYWUCJLN-TTXAVTLXSA-N
Mol Weight 354.83 g/mol
Molecular Formula C18H21ClF2N2O
Exact Mass 354.131047 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID IRmyf5ELuUh
Name N-(1-adamantyl)-N'-(2-chloro-4,5-difluorophenyl)-N-methylurea
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/C18H21ClF2N2O/c1-23(17(24)22-16-6-15(21)14(20)5-13(16)19)18-7-10-2-11(8-18)4-12(3-10)9-18/h5-6,10-12H,2-4,7-9H2,1H3,(H,22,24)/t10-,11+,12-,18-
InChIKey OCXRZJYYWUCJLN-TTXAVTLXSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_5922
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: 62478; UBI_ID: UBI-005924
Temperature 308 °C