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4H-1,3-Dioxolo[4,5-c]pyrrole-4-carboxylic acid, tetrahydro-5-(4-methoxyphenyl)-2-oxo-, methyl ester, (3a.alpha.,4.beta.,6a.alpha.)-
SpectraBase Compound ID 72UBODpp5Y6
InChI InChI=1S/C14H15NO6/c1-18-9-5-3-8(4-6-9)15-7-10-12(21-14(17)20-10)11(15)13(16)19-2/h3-6,10-12H,7H2,1-2H3/t10-,11+,12-/m1/s1
InChIKey ANUYEXAJHZNIIA-GRYCIOLGSA-N
Mol Weight 293.28 g/mol
Molecular Formula C14H15NO6
Exact Mass 293.089937 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID M1uJKY7DAt
Name 4H-1,3-Dioxolo[4,5-c]pyrrole-4-carboxylic acid, tetrahydro-5-(4-methoxyphenyl)-2-oxo-, methyl ester, (3a.alpha.,4.beta.,6a.alpha.)-
CAS Registry Number 96428-98-7
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H15NO6
InChI InChI=1S/C14H15NO6/c1-18-9-5-3-8(4-6-9)15-7-10-12(21-14(17)20-10)11(15)13(16)19-2/h3-6,10-12H,7H2,1-2H3/t10-,11+,12-/m1/s1
InChIKey ANUYEXAJHZNIIA-GRYCIOLGSA-N
Molecular Weight 293.275 g/mol
SMILES [C@]1(N(C[C@]2(OC(O[C@@]12[H])=O)[H])c1ccc(cc1)OC)(C(=O)OC)[H]
SPLASH splash10-001i-0090000000-10fd74bfc4941367a264
Source of Spectrum J-50-2313-8
Synonyms 2,4-Dioxa-7-aza-7-(p-methoxyphenyl)-8-methoxycarbonyl-bicyclo[3.3.0]octan-3-one methyl (3aS,4S,6aR)-5-(4-methoxyphenyl)-2-oxotetrahydro-3aH-[1,3]dioxolo[4,5-c]pyrrole-4-carboxylate
Wiley ID 1296209