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(E)-3-[(4R,5S)-5-[(1-hydroxy-3-keto-isoindolin-2-yl)methyl]-2,2-dimethyl-1,3-dioxolan-4-yl]acrylic acid ethyl ester
SpectraBase Compound ID ASNgVBwX0fL
InChI InChI=1S/C19H23NO6/c1-4-24-16(21)10-9-14-15(26-19(2,3)25-14)11-20-17(22)12-7-5-6-8-13(12)18(20)23/h5-10,14-15,17,22H,4,11H2,1-3H3/b10-9+/t14-,15+,17?/m1/s1
InChIKey RTAXPIRYLZMMMG-GQSXBIMYSA-N
Mol Weight 361.39 g/mol
Molecular Formula C19H23NO6
Exact Mass 361.152537 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1SrTYDAnYpu
Name (E)-3-[(4R,5S)-5-[(1-hydroxy-3-keto-isoindolin-2-yl)methyl]-2,2-dimethyl-1,3-dioxolan-4-yl]acrylic acid ethyl ester
Alternate Name(s) (E)-3-[(4R,5S)-5-[(1-hydroxy-3-oxo-1H-isoindol-2-yl)methyl]-2,2-dimethyl-1,3-dioxolan-4-yl]-2-propenoic acid ethyl ester Ethyl (E)-3-[(4R,5S)-2,2-dimethyl-5-[(1-oxidanyl-3-oxidanylidene-1H-isoindol-2-yl)methyl]-1,3-dioxolan-4-yl]prop-2-enoate Ethyl (E)-3-[(4R,5S)-5-[(1-hydroxy-3-oxo-1H-isoindol-2-yl)methyl]-2,2-dimethyl-1,3-dioxolan-4-yl]prop-2-enoate Ethyl (E)-3-[(4R,5S)-5-[(1-hydroxy-3-oxo-isoindolin-2-yl)methyl]-2,2-dimethyl-1,3-dioxolan-4-yl]prop-2-enoate
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Formula C19H23NO6
InChI InChI=1S/C19H23NO6/c1-4-24-16(21)10-9-14-15(26-19(2,3)25-14)11-20-17(22)12-7-5-6-8-13(12)18(20)23/h5-10,14-15,17,22H,4,11H2,1-3H3/b10-9+/t14-,15+,17?/m1/s1
InChIKey RTAXPIRYLZMMMG-GQSXBIMYSA-N
Molecular Weight 361.394 g/mol
SMILES OC1N(C(c2ccccc12)=O)C[C@@]1(OC(C)(C)O[C@@]1(\C=C\C(=O)OCC)[H])[H]
SPLASH splash10-001i-0900000000-fe86196e42078691afe1
Source of Spectrum KC-0-74-5
Wiley ID 786977