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6-((3r,5r,7r)-adamantan-1-yl)-4-((4-methoxybenzyl)oxy)-2-(thiophen-2-yl)furo[2,3-b]pyridine
SpectraBase Compound ID Hf1FubnfnGb
InChI InChI=1S/C29H29NO3S/c1-31-22-6-4-18(5-7-22)17-32-24-13-27(29-14-19-9-20(15-29)11-21(10-19)16-29)30-28-23(24)12-25(33-28)26-3-2-8-34-26/h2-8,12-13,19-21H,9-11,14-17H2,1H3/t19-,20+,21-,29-
InChIKey QLQXKKDCNXCBFN-HNXVDQRVSA-N
Mol Weight 471.62 g/mol
Molecular Formula C29H29NO3S
Exact Mass 471.186815 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HdJNFBw0IZP
Name 6-((3r,5r,7r)-adamantan-1-yl)-4-((4-methoxybenzyl)oxy)-2-(thiophen-2-yl)furo[2,3-b]pyridine
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Formula C29H29NO3S
InChI InChI=1S/C29H29NO3S/c1-31-22-6-4-18(5-7-22)17-32-24-13-27(29-14-19-9-20(15-29)11-21(10-19)16-29)30-28-23(24)12-25(33-28)26-3-2-8-34-26/h2-8,12-13,19-21H,9-11,14-17H2,1H3/t19-,20+,21-,29-
InChIKey QLQXKKDCNXCBFN-HNXVDQRVSA-N
Molecular Weight 471.615 g/mol
SMILES C1[C@]2(C[C@]3(C[C@@]1(CC(C2)(C3)c1nc2oc(cc2c(OCc2ccc(cc2)OC)c1)-c1cccs1)[H])[H])[H]
SPLASH splash10-00di-0901100000-471cc5d8a0c2ef402147
Source of Spectrum A1-16-2422/SM41-15
Wiley ID 1749442