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Benzyl 2-[(3-(acetylsulfanyl)-2-([(benzyloxy)carbonyl]amino)propanoyl)amino]-3-methylbutanoate
SpectraBase Compound ID 3U8thiB9CpJ
InChI InChI=1S/C25H30N2O6S/c1-17(2)22(24(30)32-14-19-10-6-4-7-11-19)27-23(29)21(16-34-18(3)28)26-25(31)33-15-20-12-8-5-9-13-20/h4-13,17,21-22H,14-16H2,1-3H3,(H,26,31)(H,27,29)
InChIKey XGVUUEXMHRXMOE-UHFFFAOYSA-N
Mol Weight 486.58 g/mol
Molecular Formula C25H30N2O6S
Exact Mass 486.182458 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID SxvsmHLJi3
Name
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Formula C25H30N2O6S
InChI InChI=1S/C25H30N2O6S/c1-17(2)22(24(30)32-14-19-10-6-4-7-11-19)27-23(29)21(16-34-18(3)28)26-25(31)33-15-20-12-8-5-9-13-20/h4-13,17,21-22H,14-16H2,1-3H3,(H,26,31)(H,27,29)
InChIKey XGVUUEXMHRXMOE-UHFFFAOYSA-N
Molecular Weight 486.1817
SMILES N(C(C(NC(C(OCc1ccccc1)=O)C(C)C)=O)CSC(=O)C)C(=O)OCc1ccccc1
SPLASH splash10-0006-9220000000-3190da287d349e2dc7f4
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany