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(5aRS,7SR,9aSR,9bSR)-6,6-(Ethylidenedioxy)decahydro-7-(phenylthio)-1H-pyrrolo[1,2-b][1,2]benzisoxazol-9-one
SpectraBase Compound ID FTtQc2EzcKP
InChI InChI=1S/C18H21NO4S/c20-14-11-15(24-12-5-2-1-3-6-12)18(21-9-10-22-18)17-16(14)13-7-4-8-19(13)23-17/h1-3,5-6,13,15-17H,4,7-11H2
InChIKey SDRYWBREBZUFOO-UHFFFAOYSA-N
Mol Weight 347.43 g/mol
Molecular Formula C18H21NO4S
Exact Mass 347.119129 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1waR5dhzA5Y
Name (5aRS,7SR,9aSR,9bSR)-6,6-(Ethylidenedioxy)decahydro-7-(phenylthio)-1H-pyrrolo[1,2-b][1,2]benzisoxazol-9-one
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Formula C18H21NO4S
InChI InChI=1S/C18H21NO4S/c20-14-11-15(24-12-5-2-1-3-6-12)18(21-9-10-22-18)17-16(14)13-7-4-8-19(13)23-17/h1-3,5-6,13,15-17H,4,7-11H2
InChIKey SDRYWBREBZUFOO-UHFFFAOYSA-N
Molecular Weight 347.429 g/mol
SMILES C12C3(C(Sc4ccccc4)CC(C1C1CCCN1O2)=O)OCCO3
SPLASH splash10-01r2-9810000000-cce1d286b139cae22eb4
Source of Spectrum J-62-7787-13
Synonyms (5aRS,7RS,9aSR,9bSR)-6,6-(Ethylidenedioxy)decahydro-7-(phenylthio)-1H-pyrrolo[1,2-b][1,2]benzisoxazol-9-one 10'-(phenylsulfanyl)-7'-oxa-6'-azaspiro[1,3-dioxolane-2,9'-tricyclo[6.4.0.0(2,6)]dodecane]-12'-one
Wiley ID 1339987