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5-Benzoyl-(1-(3,5-bis(dimethylaminomethyl))-4-hydroxyphenyl)-3-p-tolyl-1,2,3,4-tetrahydro-pyrimidine
SpectraBase Compound ID 3fgJ7sEjTjx
InChI InChI=1S/C30H36N4O2/c1-22-11-13-27(14-12-22)33-19-26(29(35)23-9-7-6-8-10-23)20-34(21-33)28-15-24(17-31(2)3)30(36)25(16-28)18-32(4)5/h6-16,20,36H,17-19,21H2,1-5H3
InChIKey WQLVDPSXGDJCMO-UHFFFAOYSA-N
Mol Weight 484.6 g/mol
Molecular Formula C30H36N4O2
Exact Mass 484.283826 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9QQ8SHEa25
Name 5-Benzoyl-(1-(3,5-bis(dimethylaminomethyl))-4-hydroxyphenyl)-3-p-tolyl-1,2,3,4-tetrahydro-pyrimidine
Appearance Brown powder
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C30H36N4O2
InChI InChI=1S/C30H36N4O2/c1-22-11-13-27(14-12-22)33-19-26(29(35)23-9-7-6-8-10-23)20-34(21-33)28-15-24(17-31(2)3)30(36)25(16-28)18-32(4)5/h6-16,20,36H,17-19,21H2,1-5H3
InChIKey WQLVDPSXGDJCMO-UHFFFAOYSA-N
Instrument Name Shimadzu GCMS QP-EX
Ionization Type EI
Literature Reference DOI 10.1002/jhet.3377
Molecular Weight 484.644 g/mol
SMILES Oc1c(cc(N2CN(CC(C(c3ccccc3)=O)=C2)c2ccc(cc2)C)cc1CN(C)C)CN(C)C
SPLASH splash10-004i-0009000000-33431f6e39530cb58e8c
Source of Spectrum Y-55-2966-9a
Wiley ID 1879002