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5-[4-[2-[(6-hydroxy-2,5,7,8-tetramethyl-chroman-2-yl)methyl-methyl-amino]ethoxy]benzyl]thiazolidine-2,4-quinone
SpectraBase Compound ID GVd8nRCdaWw
InChI InChI=1S/C27H34N2O5S/c1-16-17(2)24-21(18(3)23(16)30)10-11-27(4,34-24)15-29(5)12-13-33-20-8-6-19(7-9-20)14-22-25(31)28-26(32)35-22/h6-9,22,30H,10-15H2,1-5H3,(H,28,31,32)
InChIKey PUZNPKYWTAXHCD-UHFFFAOYSA-N
Mol Weight 498.6 g/mol
Molecular Formula C27H34N2O5S
Exact Mass 498.218843 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4PtlLNdz9Um
Name 5-[4-[2-[(6-hydroxy-2,5,7,8-tetramethyl-chroman-2-yl)methyl-methyl-amino]ethoxy]benzyl]thiazolidine-2,4-quinone
Alternate Name(s) 5-[[4-[2-[(6-hydroxy-2,5,7,8-tetramethyl-3,4-dihydro-2H-1-benzopyran-2-yl)methyl-methylamino]ethoxy]phenyl]methyl]thiazolidine-2,4-dione 5-[[4-[2-[(6-hydroxy-2,5,7,8-tetramethyl-3,4-dihydrochromen-2-yl)methyl-methylamino]ethoxy]phenyl]methyl]-1,3-thiazolidine-2,4-dione 5-[[4-[2-[(6-hydroxy-2,5,7,8-tetramethyl-chroman-2-yl)methyl-methyl-amino]ethoxy]phenyl]methyl]thiazolidine-2,4-dione 5-[[4-[2-[methyl-[(2,5,7,8-tetramethyl-6-oxidanyl-3,4-dihydrochromen-2-yl)methyl]amino]ethoxy]phenyl]methyl]-1,3-thiazolidine-2,4-dione
Comments Less than 3 mono-isotopic peaks
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Formula C27H34N2O5S
InChI InChI=1S/C27H34N2O5S/c1-16-17(2)24-21(18(3)23(16)30)10-11-27(4,34-24)15-29(5)12-13-33-20-8-6-19(7-9-20)14-22-25(31)28-26(32)35-22/h6-9,22,30H,10-15H2,1-5H3,(H,28,31,32)
InChIKey PUZNPKYWTAXHCD-UHFFFAOYSA-N
Molecular Weight 498.638 g/mol
SMILES N1C(C(Cc2ccc(OCCN(CC3(CCc4c(c(c(c(c4O3)C)C)O)C)C)C)cc2)SC1=O)=O
SPLASH splash10-000i-0090000000-8f96a8b9361ac2912fe2
Source of Spectrum F2-42-3274-11
Wiley ID 1600271