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Methyl (3S,9bR)-2,3,5,9b-tetrahydro-9b-hydroxy-2,2-dimethyl-5-oxo-1H-pyrrolo[2,1-a]isoindol-3-carboxylate
SpectraBase Compound ID 2wGqA9hgUG9
InChI InChI=1S/C15H17NO4/c1-14(2)8-15(19)10-7-5-4-6-9(10)12(17)16(15)11(14)13(18)20-3/h4-7,11,19H,8H2,1-3H3/t11-,15-/m1/s1
InChIKey ZDFWBNPEBRAULR-IAQYHMDHSA-N
Mol Weight 275.3 g/mol
Molecular Formula C15H17NO4
Exact Mass 275.115758 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 24pTP0EVQ8
Name Methyl (3S,9bR)-2,3,5,9b-tetrahydro-9b-hydroxy-2,2-dimethyl-5-oxo-1H-pyrrolo[2,1-a]isoindol-3-carboxylate
CAS Registry Number 137649-43-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H17NO4
InChI InChI=1S/C15H17NO4/c1-14(2)8-15(19)10-7-5-4-6-9(10)12(17)16(15)11(14)13(18)20-3/h4-7,11,19H,8H2,1-3H3/t11-,15-/m1/s1
InChIKey ZDFWBNPEBRAULR-IAQYHMDHSA-N
Molecular Weight 275.304 g/mol
SMILES O[C@]12N(C(c3ccccc23)=O)[C@@](C(C)(C)C1)(C(=O)OC)[H]
SPLASH splash10-001r-9420000000-e12dcdc739d251630760
Source of Spectrum K-125-2472-2
Synonyms Methyl (3S,9bR)-9b-hydroxy-2,2-dimethyl-5-oxo-2,3,5,9b-tetrahydro-1H-pyrrolo[2,1-a]isoindole-3-carboxylate
Wiley ID 1279091