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(3S,6R)-3-Benzyl-3,6-dihydro-6-methyl-6-(1'-methylethyl)-5-(N-methyl-N-phenylamino)pyrazin-2(1H)-one
SpectraBase Compound ID K3rIlByOdjx
InChI InChI=1S/C22H27N3O/c1-16(2)22(3)21(25(4)18-13-9-6-10-14-18)23-19(20(26)24-22)15-17-11-7-5-8-12-17/h5-14,16,19H,15H2,1-4H3,(H,24,26)/t19-,22+/m0/s1
InChIKey UOSORUFBJKBFPF-SIKLNZKXSA-N
Mol Weight 349.48 g/mol
Molecular Formula C22H27N3O
Exact Mass 349.215413 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HfGBll7xAgI
Name (3S,6R)-3-Benzyl-3,6-dihydro-6-methyl-6-(1'-methylethyl)-5-(N-methyl-N-phenylamino)pyrazin-2(1H)-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H27N3O
InChI InChI=1S/C22H27N3O/c1-16(2)22(3)21(25(4)18-13-9-6-10-14-18)23-19(20(26)24-22)15-17-11-7-5-8-12-17/h5-14,16,19H,15H2,1-4H3,(H,24,26)/t19-,22+/m0/s1
InChIKey UOSORUFBJKBFPF-SIKLNZKXSA-N
Molecular Weight 349.478 g/mol
SMILES N1C([C@@](N=C([C@]1(C(C)C)C)N(c1ccccc1)C)(Cc1ccccc1)[H])=O
SPLASH splash10-066s-0094000000-2ee72de7491538c9bd24
Source of Spectrum H-78-1830-0
Synonyms (3S,6R)-3-benzyl-6-isopropyl-6-methyl-5-(methylanilino)-3,6-dihydro-2(1H)-pyrazinone
Wiley ID 1341505