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N-(1-adamantyl)-N'-[(1-ethyl-5-methyl-1H-pyrazol-4-yl)methyl]urea
SpectraBase Compound ID KgNJnSSgriU
InChI InChI=1S/C18H28N4O/c1-3-22-12(2)16(11-20-22)10-19-17(23)21-18-7-13-4-14(8-18)6-15(5-13)9-18/h11,13-15H,3-10H2,1-2H3,(H2,19,21,23)/t13-,14+,15-,18-
InChIKey YGLLEEQVSZEPHQ-OVMOHIIOSA-N
Mol Weight 316.45 g/mol
Molecular Formula C18H28N4O
Exact Mass 316.226312 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID KFBplDuoqi5
Name N-(1-adamantyl)-N'-[(1-ethyl-5-methyl-1H-pyrazol-4-yl)methyl]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/C18H28N4O/c1-3-22-12(2)16(11-20-22)10-19-17(23)21-18-7-13-4-14(8-18)6-15(5-13)9-18/h11,13-15H,3-10H2,1-2H3,(H2,19,21,23)/t13-,14+,15-,18-
InChIKey YGLLEEQVSZEPHQ-OVMOHIIOSA-N
NMR Offset 14.9946
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_20133
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: UZI/9158409; UBI_ID: UBI-020137
Temperature 313 °C