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N,N-Dibenzyl-1-[6-(4-chlorophenyl)-2-methyl-4-pyrimidinyl]-2-methyl-1-propanamine
SpectraBase Compound ID 4cmlAOXweTe
InChI InChI=1S/C29H30ClN3/c1-21(2)29(28-18-27(31-22(3)32-28)25-14-16-26(30)17-15-25)33(19-23-10-6-4-7-11-23)20-24-12-8-5-9-13-24/h4-18,21,29H,19-20H2,1-3H3
InChIKey QOYMYRVXPPKXGZ-UHFFFAOYSA-N
Mol Weight 456.03 g/mol
Molecular Formula C29H30ClN3
Exact Mass 455.212826 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GgVRaSQzQrn
Name N,N-Dibenzyl-1-[6-(4-chlorophenyl)-2-methyl-4-pyrimidinyl]-2-methyl-1-propanamine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C29H30ClN3
InChI InChI=1S/C29H30ClN3/c1-21(2)29(28-18-27(31-22(3)32-28)25-14-16-26(30)17-15-25)33(19-23-10-6-4-7-11-23)20-24-12-8-5-9-13-24/h4-18,21,29H,19-20H2,1-3H3
InChIKey QOYMYRVXPPKXGZ-UHFFFAOYSA-N
Molecular Weight 456.033 g/mol
SMILES C(C(C)C)(N(Cc1ccccc1)Cc1ccccc1)c1nc(nc(c1)-c1ccc(cc1)Cl)C
SPLASH splash10-0002-4390000000-c674937ae336cd2e4776
Source of Spectrum C5-2004-2022-6
Synonyms N,N-dibenzyl-N-{1-[6-(4-chlorophenyl)-2-methyl-4-pyrimidinyl]-2-methylpropyl}amine
Wiley ID 1617187