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(3RS,3aSR,6SR,7aRS)-2-[2-(Acetylthio)ethyl]-1-oxo-1,2,3,6,7,7a-hexahydro-3a,6-epoxyisoindol-3-yl acetate
SpectraBase Compound ID 1albKLCACSO
InChI InChI=1S/C14H17NO5S/c1-8(16)19-13-14-4-3-10(20-14)7-11(14)12(18)15(13)5-6-21-9(2)17/h3-4,10-11,13H,5-7H2,1-2H3
InChIKey SDUBLDUIBXVXBL-UHFFFAOYSA-N
Mol Weight 311.35 g/mol
Molecular Formula C14H17NO5S
Exact Mass 311.082744 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6cYoXBDjIZq
Name (3RS,3aSR,6SR,7aRS)-2-[2-(Acetylthio)ethyl]-1-oxo-1,2,3,6,7,7a-hexahydro-3a,6-epoxyisoindol-3-yl acetate
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Formula C14H17NO5S
InChI InChI=1S/C14H17NO5S/c1-8(16)19-13-14-4-3-10(20-14)7-11(14)12(18)15(13)5-6-21-9(2)17/h3-4,10-11,13H,5-7H2,1-2H3
InChIKey SDUBLDUIBXVXBL-UHFFFAOYSA-N
Molecular Weight 311.352 g/mol
SMILES C123C(C(=O)N(C3OC(=O)C)CCSC(=O)C)CC(O1)C=C2
SPLASH splash10-0a4i-9780000000-2ff8fa7691051ea9c304
Source of Spectrum F-70-1681-27
Synonyms 2-(2-(acetylthio)ethyl)-1-oxo-1,2,3,6,7,7a-hexahydro-3a,6-epoxyisoindol-3-yl acetate
Wiley ID 1742911