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1-Benzoyl-(2S)-isopropyl-(5S)-(4-methoxyphenyl)perhydropyrimidin-4-one
SpectraBase Compound ID IXaO5DsdKmV
InChI InChI=1S/C21H24N2O3/c1-14(2)18-13-23(21(25)16-7-5-4-6-8-16)19(22-20(18)24)15-9-11-17(26-3)12-10-15/h4-12,14,18-19H,13H2,1-3H3,(H,22,24)/t18-,19+/m1/s1
InChIKey IARSFFLZLKPXGZ-MOPGFXCFSA-N
Mol Weight 352.43 g/mol
Molecular Formula C21H24N2O3
Exact Mass 352.178693 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IzZnLZCH9Fq
Name 1-Benzoyl-(2S)-isopropyl-(5S)-(4-methoxyphenyl)perhydropyrimidin-4-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H24N2O3
InChI InChI=1S/C21H24N2O3/c1-14(2)18-13-23(21(25)16-7-5-4-6-8-16)19(22-20(18)24)15-9-11-17(26-3)12-10-15/h4-12,14,18-19H,13H2,1-3H3,(H,22,24)/t18-,19+/m1/s1
InChIKey IARSFFLZLKPXGZ-MOPGFXCFSA-N
Molecular Weight 352.434 g/mol
SMILES N1C([C@](CN([C@]1(c1ccc(cc1)OC)[H])C(=O)c1ccccc1)(C(C)C)[H])=O
SPLASH splash10-0a4i-0945000000-8505e7b09b33078400f4
Source of Spectrum U1-2010-6401-23e
Wiley ID 1664596