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N-Acetyl-3,4-Diacetoxy-5-phenyl-2-(1-adamantylthio)pyridine
SpectraBase Compound ID HkJXnY3FWUV
InChI InChI=1S/C27H33NO5S/c1-16(29)28-15-23(22-7-5-4-6-8-22)24(32-17(2)30)25(33-18(3)31)26(28)34-27-12-19-9-20(13-27)11-21(10-19)14-27/h4-8,15,19-21,24-26H,9-14H2,1-3H3
InChIKey XHKMAJQWJGMRFB-UHFFFAOYSA-N
Mol Weight 483.6 g/mol
Molecular Formula C27H33NO5S
Exact Mass 483.207944 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID MlcwcImYl8
Name N-Acetyl-3,4-Diacetoxy-5-phenyl-2-(1-adamantylthio)pyridine
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Formula C27H33NO5S
InChI InChI=1S/C27H33NO5S/c1-16(29)28-15-23(22-7-5-4-6-8-22)24(32-17(2)30)25(33-18(3)31)26(28)34-27-12-19-9-20(13-27)11-21(10-19)14-27/h4-8,15,19-21,24-26H,9-14H2,1-3H3
InChIKey XHKMAJQWJGMRFB-UHFFFAOYSA-N
Molecular Weight 483.623 g/mol
SMILES C1(N(C=C(C(C1OC(=O)C)OC(=O)C)c1ccccc1)C(=O)C)SC12CC3CC(C2)CC(C1)C3
SPLASH splash10-03k9-3790000000-e3c0c826a1729fd91aca
Source of Spectrum Y-28-1057-19
Synonyms 1-Acetyl-3-(acetyloxy)-2-(1-adamantylsulfanyl)-5-phenyl-1,2,3,4-tetrahydro-4-pyridinyl acetate N-acetyl-2-(1'-adamantylthio)-3,4-bis(acetoxy)-5-phenyl-1,2,3,4-tetrtahydropyridine
Wiley ID 1395838