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(5aRS,9aSR,9bSR)-1,2,3,5a,6,9,9a,9b-octahydro-6,6-dimethoxypyrrolo[1,2-b][1,2]benzisoxazol-9-one
SpectraBase Compound ID 7yf73jzKl7X
InChI InChI=1S/C12H17NO4/c1-15-12(16-2)6-5-9(14)10-8-4-3-7-13(8)17-11(10)12/h5-6,8,10-11H,3-4,7H2,1-2H3
InChIKey VUIDMRUVKUVFGE-UHFFFAOYSA-N
Mol Weight 239.27 g/mol
Molecular Formula C12H17NO4
Exact Mass 239.115758 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9EQH3kIEoDU
Name (5aRS,9aSR,9bSR)-1,2,3,5a,6,9,9a,9b-octahydro-6,6-dimethoxypyrrolo[1,2-b][1,2]benzisoxazol-9-one
Alternate Name(s) (5aRS,9aSR,9bRS)-1,2,3,5a,6,9,9a,9b-octahydro-6,6-dimethoxypyrrolo[1,2-b][1,2]benzisoxazol-9-one 6,6-Dimethoxy-2,3,5a,6,9a,9b-hexahydro-1H-benzo[d]pyrrolo[1,2-b]isoxazol-9-one 6,6-Dimethoxy-2,3,5a,6,9a,9b-hexahydropyrrolo[1,2-b][1,2]benzisoxazol-9(1H)-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H17NO4
InChI InChI=1S/C12H17NO4/c1-15-12(16-2)6-5-9(14)10-8-4-3-7-13(8)17-11(10)12/h5-6,8,10-11H,3-4,7H2,1-2H3
InChIKey VUIDMRUVKUVFGE-UHFFFAOYSA-N
Molecular Weight 239.271 g/mol
SMILES C12C(C3CCCN3O2)C(=O)C=CC1(OC)OC
SPLASH splash10-0fe0-4910000000-2cc79ffb1704e71ae322
Source of Spectrum J-62-7785-5
Wiley ID 1241857