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(4RS,4aRS,7aSR)-6-Benzyl-2-ethyl-4-methyl-5-oxo-4a,5,6,7,7a,8-hexahydro-4H-furo[2,3-f]isoindole-4-carboxylic acid
SpectraBase Compound ID 6q6HDPA4rbY
InChI InChI=1S/C21H23NO4/c1-3-15-10-16-17(26-15)9-14-12-22(11-13-7-5-4-6-8-13)19(23)18(14)21(16,2)20(24)25/h4-8,10,14,18H,3,9,11-12H2,1-2H3,(H,24,25)/t14-,18+,21+/m0/s1
InChIKey FYJAZXSRQWZHGK-FIKMYACPSA-N
Mol Weight 353.42 g/mol
Molecular Formula C21H23NO4
Exact Mass 353.162708 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DOyPdxeMRsw
Name (4RS,4aRS,7aSR)-6-Benzyl-2-ethyl-4-methyl-5-oxo-4a,5,6,7,7a,8-hexahydro-4H-furo[2,3-f]isoindole-4-carboxylic acid
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Formula C21H23NO4
InChI InChI=1S/C21H23NO4/c1-3-15-10-16-17(26-15)9-14-12-22(11-13-7-5-4-6-8-13)19(23)18(14)21(16,2)20(24)25/h4-8,10,14,18H,3,9,11-12H2,1-2H3,(H,24,25)/t14-,18+,21+/m0/s1
InChIKey FYJAZXSRQWZHGK-FIKMYACPSA-N
Literature Reference DOI 10.1016/j.tet.2016.03.023
Molecular Weight 353.418 g/mol
SMILES OC([C@@]1(c2cc(oc2C[C@@]2([C@]1([H])C(=O)N(Cc1ccccc1)C2)[H])CC)C)=O
SPLASH splash10-052f-9123000000-2464ae31a48224b94e6e
Source of Spectrum F-72-2248-14.21
Synonyms (4S,4aS,7aR)-6-benzyl-2-ethyl-4-methyl-5-oxo-4a,5,6,7,7a,8-hexahydro-4H-furo[2,3-f]isoindole-4-carboxylic acid
Wiley ID 1805903