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1,3-bis[(4-methoxyphenyl)methyl]-2-[2-[(4-nitrophenyl)methoxy]phenyl]-1,3-diazinane
SpectraBase Compound ID H9MjZMZoUnM
InChI InChI=1S/C33H35N3O5/c1-39-29-16-10-25(11-17-29)22-34-20-5-21-35(23-26-12-18-30(40-2)19-13-26)33(34)31-6-3-4-7-32(31)41-24-27-8-14-28(15-9-27)36(37)38/h3-4,6-19,33H,5,20-24H2,1-2H3
InChIKey IEYVMQFMLMJZDS-UHFFFAOYSA-N
Mol Weight 553.7 g/mol
Molecular Formula C33H35N3O5
Exact Mass 553.257671 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9Enje9YNYLc
Name 1,3-bis[(4-methoxyphenyl)methyl]-2-[2-[(4-nitrophenyl)methoxy]phenyl]-1,3-diazinane
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C33H35N3O5
InChI InChI=1S/C33H35N3O5/c1-39-29-16-10-25(11-17-29)22-34-20-5-21-35(23-26-12-18-30(40-2)19-13-26)33(34)31-6-3-4-7-32(31)41-24-27-8-14-28(15-9-27)36(37)38/h3-4,6-19,33H,5,20-24H2,1-2H3
InChIKey IEYVMQFMLMJZDS-UHFFFAOYSA-N
Molecular Weight 553.659 g/mol
SMILES C1(N(Cc2ccc(cc2)OC)CCCN1Cc1ccc(cc1)OC)c1c(OCc2ccc(N(=O)=O)cc2)cccc1
SPLASH splash10-00di-3901000000-8ad867907834d0b19211
Synonyms 1,3-bis[(4-methoxyphenyl)methyl]-2-[2-[(4-nitrophenyl)methoxy]phenyl]hexahydropyrimidine 2-[2-(4-nitrobenzyl)oxyphenyl]-1,3-bis(p-anisyl)hexahydropyrimidine
Wiley ID 1436813