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N-(3-chlorobenzyl)-N-(3-cyclohexen-1-ylmethyl)-N'-phenylurea

View entire compound with spectra: 2 NMR

N-(3-chlorobenzyl)-N-(3-cyclohexen-1-ylmethyl)-N'-phenylurea
SpectraBase Compound ID CVocf6b5gUy
InChI InChI=1S/C21H23ClN2O/c22-19-11-7-10-18(14-19)16-24(15-17-8-3-1-4-9-17)21(25)23-20-12-5-2-6-13-20/h1-3,5-7,10-14,17H,4,8-9,15-16H2,(H,23,25)
InChIKey YJFSCXWPZIIMSR-UHFFFAOYSA-N
Mol Weight 354.88 g/mol
Molecular Formula C21H23ClN2O
Exact Mass 354.149891 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1CQtmeoPg9Q
Name N-(3-Chlorobenzyl)-N-(3-cyclohexen-1-ylmethyl)-N'-phenylurea
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 354.149891068 u
Formula C21H23ClN2O
InChI InChI=1S/C21H23ClN2O/c22-19-11-7-10-18(14-19)16-24(15-17-8-3-1-4-9-17)21(25)23-20-12-5-2-6-13-20/h1-3,5-7,10-14,17H,4,8-9,15-16H2,(H,23,25)
InChIKey YJFSCXWPZIIMSR-UHFFFAOYSA-N
Molecular Weight 354.881 g/mol
SMILES N(C(N(CC1=CC(Cl)=CC=C1)CC1CC=CCC1)=O)C=1C=CC=CC1