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3-[(1S,9bS)-1-carbomethoxy-9b-hydroxy-5-keto-2,3-dihydro-1H-pyrrolo[5,1-a]isoindol-3-yl]propionic acid
SpectraBase Compound ID 9Wco1ZscGAU
InChI InChI=1S/C16H17NO6/c1-23-15(21)12-8-9(6-7-13(18)19)17-14(20)10-4-2-3-5-11(10)16(12,17)22/h2-5,9,12,22H,6-8H2,1H3,(H,18,19)/t9?,12-,16-/m1/s1
InChIKey ONFMPUMKBXMAEK-MIFHBTQPSA-N
Mol Weight 319.31 g/mol
Molecular Formula C16H17NO6
Exact Mass 319.105587 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1gvjAXUPOQm
Name 3-[(1S,9bS)-1-carbomethoxy-9b-hydroxy-5-keto-2,3-dihydro-1H-pyrrolo[5,1-a]isoindol-3-yl]propionic acid
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H17NO6
InChI InChI=1S/C16H17NO6/c1-23-15(21)12-8-9(6-7-13(18)19)17-14(20)10-4-2-3-5-11(10)16(12,17)22/h2-5,9,12,22H,6-8H2,1H3,(H,18,19)/t9?,12-,16-/m1/s1
InChIKey ONFMPUMKBXMAEK-MIFHBTQPSA-N
Literature Reference Author ORGANIC_CHEMISTRY_(NMR-DEPARTMENT);UNIVERSITY_MAINZ
Literature Reference Citation UNI_MAINZ,INTERNAL_DB(2006)
Molecular Weight 319.314 g/mol
Source File Reference MHKO101