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(R)-5-(Benzyloxymethyl)-3-(3-benzylthio-2-methoxypropeoxy)-2-methylpyridine-4-carbaldehyde dimethyl acetal
SpectraBase Compound ID LbBJZ62Mcv4
InChI InChI=1S/C28H35NO5S/c1-21-27(34-18-25(30-2)20-35-19-23-13-9-6-10-14-23)26(28(31-3)32-4)24(15-29-21)17-33-16-22-11-7-5-8-12-22/h5-15,25,28H,16-20H2,1-4H3/t25-/m1/s1
InChIKey PPBAFHOQQYDSTA-RUZDIDTESA-N
Mol Weight 497.7 g/mol
Molecular Formula C28H35NO5S
Exact Mass 497.223594 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID gp8vSxLRwC
Name (R)-5-(Benzyloxymethyl)-3-(3-benzylthio-2-methoxypropeoxy)-2-methylpyridine-4-carbaldehyde dimethyl acetal
Alternate Name(s) 5-[(benzyloxy)methyl]-3-{[(2R)-3-(benzylsulfanyl)-2-methoxypropyl]oxy}-4-(dimethoxymethyl)-2-methylpyridine
Comments Less than 3 mono-isotopic peaks
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Formula C28H35NO5S
InChI InChI=1S/C28H35NO5S/c1-21-27(34-18-25(30-2)20-35-19-23-13-9-6-10-14-23)26(28(31-3)32-4)24(15-29-21)17-33-16-22-11-7-5-8-12-22/h5-15,25,28H,16-20H2,1-4H3/t25-/m1/s1
InChIKey PPBAFHOQQYDSTA-RUZDIDTESA-N
Molecular Weight 497.650 g/mol
SMILES c1(c(OC[C@@](OC)(CSCc2ccccc2)[H])c(C)ncc1COCc1ccccc1)C(OC)OC
SPLASH splash10-0006-9000000000-ff837a08c38461c2e891
Source of Spectrum F-55-12119-9
Wiley ID 839526