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1-[(1R,4S,6R,7S)-7-benzoxy-4-(benzoxymethyl)-2,5-dioxabicyclo[2.2.1]heptan-6-yl]-2-pyridone
SpectraBase Compound ID KmIwnDMpBWf
InChI InChI=1S/C25H25NO5/c27-21-13-7-8-14-26(21)24-22-23(29-16-20-11-5-2-6-12-20)25(31-24,18-30-22)17-28-15-19-9-3-1-4-10-19/h1-14,22-24H,15-18H2/t22-,23+,24-,25+/m1/s1
InChIKey UMEYUMGJDPVJRN-RCTAOEEJSA-N
Mol Weight 419.48 g/mol
Molecular Formula C25H25NO5
Exact Mass 419.173273 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 17CjK5ZvzLt
Name 1-[(1R,4S,6R,7S)-7-benzoxy-4-(benzoxymethyl)-2,5-dioxabicyclo[2.2.1]heptan-6-yl]-2-pyridone
Comments Less than 3 mono-isotopic peaks
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Formula C25H25NO5
InChI InChI=1S/C25H25NO5/c27-21-13-7-8-14-26(21)24-22-23(29-16-20-11-5-2-6-12-20)25(31-24,18-30-22)17-28-15-19-9-3-1-4-10-19/h1-14,22-24H,15-18H2/t22-,23+,24-,25+/m1/s1
InChIKey UMEYUMGJDPVJRN-RCTAOEEJSA-N
Molecular Weight 419.477 g/mol
SMILES [C@@]1(N2C(C=CC=C2)=O)([C@]2([C@](OCc3ccccc3)([C@@](O1)(CO2)COCc1ccccc1)[H])[H])[H]
SPLASH splash10-0006-9000100000-26cfdff1099f5683d0f8
Source of Spectrum QF-8-4801-3
Synonyms 1-[(1R,4S,6R,7S)-7-benzyloxy-4-(benzyloxymethyl)-2,5-dioxabicyclo[2.2.1]heptan-6-yl]pyridin-2-one 1-[(1R,4S,6R,7S)-7-phenylmethoxy-4-(phenylmethoxymethyl)-2,5-dioxabicyclo[2.2.1]heptan-6-yl]-2-pyridinone 1-[(1R,4S,6R,7S)-7-phenylmethoxy-4-(phenylmethoxymethyl)-2,5-dioxabicyclo[2.2.1]heptan-6-yl]pyridin-2-one
Wiley ID 1558101