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1,4-Phenylenebis((1-(p-tolyl)-1,2,3,4-tetrahydropyrimidin-5 yl)methanone)
SpectraBase Compound ID A6Oc74WGc2r
InChI InChI=1S/C30H30N4O2/c1-21-3-11-27(12-4-21)33-17-25(15-31-19-33)29(35)23-7-9-24(10-8-23)30(36)26-16-32-20-34(18-26)28-13-5-22(2)6-14-28/h3-14,17-18,31-32H,15-16,19-20H2,1-2H3
InChIKey NOJWGRXQPZHHAJ-UHFFFAOYSA-N
Mol Weight 478.6 g/mol
Molecular Formula C30H30N4O2
Exact Mass 478.236876 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CctFTfdXEys
Name 1,4-Phenylenebis((1-(p-tolyl)-1,2,3,4-tetrahydropyrimidin-5 yl)methanone)
Appearance Yellow powder
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C30H30N4O2
InChI InChI=1S/C30H30N4O2/c1-21-3-11-27(12-4-21)33-17-25(15-31-19-33)29(35)23-7-9-24(10-8-23)30(36)26-16-32-20-34(18-26)28-13-5-22(2)6-14-28/h3-14,17-18,31-32H,15-16,19-20H2,1-2H3
InChIKey NOJWGRXQPZHHAJ-UHFFFAOYSA-N
Instrument Name Shimadzu GCMS QP-EX
Ionization Type EI
Literature Reference DOI 10.1002/jhet.3377
Molecular Weight 478.596 g/mol
SMILES N1CN(C=C(C(c2ccc(C(C=3CNCN(C3)c3ccc(cc3)C)=O)cc2)=O)C1)c1ccc(cc1)C
SPLASH splash10-001l-9000100000-da0adfd9e8728a17abf3
Source of Spectrum Y-55-2969-21a
Wiley ID 1878988