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(9a' R)-4'-Benzyl-2'-methyl-7'-2-(methylthio)ethyl]octahydro-spiro(cyclopropane-1,1'-[2H]-pyrazino[1,2-a]pyrazine-3',6',9'-trione
SpectraBase Compound ID FYiFVFZsPEx
InChI InChI=1S/C20H25N3O3S/c1-22-19(26)15(12-13-6-4-3-5-7-13)23-16(20(22)9-10-20)17(24)21-14(18(23)25)8-11-27-2/h3-7,14-16H,8-12H2,1-2H3,(H,21,24)/t14?,15?,16-/m0/s1
InChIKey USIBLAOAYSPZAQ-GPANFISMSA-N
Mol Weight 387.5 g/mol
Molecular Formula C20H25N3O3S
Exact Mass 387.161663 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CySFW41Orkr
Name (9a' R)-4'-Benzyl-2'-methyl-7'-2-(methylthio)ethyl]octahydro-spiro(cyclopropane-1,1'-[2H]-pyrazino[1,2-a]pyrazine-3',6',9'-trione
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Formula C20H25N3O3S
InChI InChI=1S/C20H25N3O3S/c1-22-19(26)15(12-13-6-4-3-5-7-13)23-16(20(22)9-10-20)17(24)21-14(18(23)25)8-11-27-2/h3-7,14-16H,8-12H2,1-2H3,(H,21,24)/t14?,15?,16-/m0/s1
InChIKey USIBLAOAYSPZAQ-GPANFISMSA-N
Molecular Weight 387.498 g/mol
SMILES N1C(C(N2C(C(N(C3([C@@]2(C1=O)[H])CC3)C)=O)Cc1ccccc1)=O)CCSC
SPLASH splash10-029i-0359000000-54df5d439e252c27aeed
Source of Spectrum U1-1999-1355-14
Wiley ID 752980