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Diethyl 2-[2,3-dihydro-4-iodo-1(2H)-oxoisoindolyl]-L-glutarate
SpectraBase Compound ID DHOZUs7u9IS
InChI InChI=1S/C17H20INO5/c1-3-23-15(20)9-8-14(17(22)24-4-2)19-10-12-11(16(19)21)6-5-7-13(12)18/h5-7,14H,3-4,8-10H2,1-2H3/t14-/m0/s1
InChIKey OFNLCIVHULMVHG-AWEZNQCLSA-N
Mol Weight 445.25 g/mol
Molecular Formula C17H20INO5
Exact Mass 445.038618 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID F5tT86VxyOd
Name Diethyl 2-[2,3-dihydro-4-iodo-1(2H)-oxoisoindolyl]-L-glutarate
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Formula C17H20INO5
InChI InChI=1S/C17H20INO5/c1-3-23-15(20)9-8-14(17(22)24-4-2)19-10-12-11(16(19)21)6-5-7-13(12)18/h5-7,14H,3-4,8-10H2,1-2H3/t14-/m0/s1
InChIKey OFNLCIVHULMVHG-AWEZNQCLSA-N
Molecular Weight 445.253 g/mol
SMILES C1(N(Cc2c(cccc12)I)[C@](C(=O)OCC)(CCC(=O)OCC)[H])=O
SPLASH splash10-0002-0089200000-4f30cb3b263034f7cfc2
Source of Spectrum J-62-5399-30
Synonyms (S)-Diethyl 2-[2,3-dihydro-4-iodo-1(2H)-oxoisoindolyl]-L-glutarate Diethyl 2-(4-iodo-1-oxo-1,3-dihydro-2H-isoindol-2-yl)pentanedioate (2S)-2-(7-iodo-3-oxo-1H-isoindol-2-yl)pentanedioic acid diethyl ester Diethyl (2S)-2-(7-iodo-3-oxo-1H-isoindol-2-yl)pentanedioate Diethyl (2S)-2-(4-iodo-1-oxo-isoindolin-2-yl)pentanedioate Diethyl (2S)-2-(7-iodanyl-3-oxidanylidene-1H-isoindol-2-yl)pentanedioate
Wiley ID 1386291