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4-(4-Acetyl-phenyl)-1-hydroxymethyl-10-oxa-4-aza-tricyclo[5.2.1.0(2,6)]dec-8-ene-3,5-dione
SpectraBase Compound ID IiBvjH16Bo
InChI InChI=1S/C17H15NO5/c1-9(20)10-2-4-11(5-3-10)18-15(21)13-12-6-7-17(8-19,23-12)14(13)16(18)22/h2-7,12-14,19H,8H2,1H3/t12-,13?,14?,17-/m0/s1
InChIKey PEHNGVCKIJVITR-VWLISTAJSA-N
Mol Weight 313.31 g/mol
Molecular Formula C17H15NO5
Exact Mass 313.095023 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID C2jRH4oiSXX
Name 4-(4-Acetyl-phenyl)-1-hydroxymethyl-10-oxa-4-aza-tricyclo[5.2.1.0(2,6)]dec-8-ene-3,5-dione
Alternate Name(s) 2-(4-acetylphenyl)-7-(hydroxymethyl)-4,7a-dihydro-3aH-octahydro-1H-4,7-epoxyisoindole-1,3-dione 2-(4-Ethanoylphenyl)-7-(hydroxymethyl)-4,7a-dihydro-3aH-octahydro-1H-4,7-epoxyisoindole-1,3-dione
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Formula C17H15NO5
InChI InChI=1S/C17H15NO5/c1-9(20)10-2-4-11(5-3-10)18-15(21)13-12-6-7-17(8-19,23-12)14(13)16(18)22/h2-7,12-14,19H,8H2,1H3/t12-,13?,14?,17-/m0/s1
InChIKey PEHNGVCKIJVITR-VWLISTAJSA-N
Molecular Weight 313.309 g/mol
SMILES OC[C@]12C3C(C(=O)N(C3=O)c3ccc(cc3)C(=O)C)[C@@](O2)(C=C1)[H]
SPLASH splash10-0udm-9240000000-e208700e6f6e0b1aa849
Wiley ID 1466488