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(E)-1-(p-Toluenesulfonyl)-2-(4-methoxybenzoylmethylene)hexahydropyrimidine
SpectraBase Compound ID 5l5XkzRb5bA
InChI InChI=1S/C20H22N2O4S/c1-15-4-10-18(11-5-15)27(24,25)22-13-3-12-21-20(22)14-19(23)16-6-8-17(26-2)9-7-16/h4-11,14,21H,3,12-13H2,1-2H3/b20-14+
InChIKey UXRIGTYRWVXULA-XSFVSMFZSA-N
Mol Weight 386.47 g/mol
Molecular Formula C20H22N2O4S
Exact Mass 386.130028 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BZTLkXjSNJ0
Name (E)-1-(p-Toluenesulfonyl)-2-(4-methoxybenzoylmethylene)hexahydropyrimidine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H22N2O4S
InChI InChI=1S/C20H22N2O4S/c1-15-4-10-18(11-5-15)27(24,25)22-13-3-12-21-20(22)14-19(23)16-6-8-17(26-2)9-7-16/h4-11,14,21H,3,12-13H2,1-2H3/b20-14+
InChIKey UXRIGTYRWVXULA-XSFVSMFZSA-N
Molecular Weight 386.466 g/mol
SMILES N1CCCN(\C1=C/C(c1ccc(cc1)OC)=O)S(c1ccc(cc1)C)(=O)=O
SPLASH splash10-000i-0931000000-c518ac83dfcdc6b5fb96
Source of Spectrum HAC-10-300-5c
Synonyms (E)-1-(4-methoxyphenyl)-2-(1-tosyltetrahydropyrimidin-2(1H)-ylidene)ethan-1-one
Wiley ID 1783247