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Cyclopenta-1,3-dioxin-4a(4H)-acetic acid, 2-(1,1-dimethylethyl)tetrahydro-.alpha.-methyl-4-oxo-, methyl ester, [2S-[2.alpha.,4a.beta.(S*),7a.beta.]]-
SpectraBase Compound ID 5tM09kZpcRR
InChI InChI=1S/C15H24O5/c1-9(11(16)18-5)15-8-6-7-10(15)19-13(14(2,3)4)20-12(15)17/h9-10,13H,6-8H2,1-5H3/t9?,10-,13-,15?/m0/s1
InChIKey ZTGWTEBGHRCZJH-JTMGSUHQSA-N
Mol Weight 284.35 g/mol
Molecular Formula C15H24O5
Exact Mass 284.162374 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID A0wVmSvpZsZ
Name Cyclopenta-1,3-dioxin-4a(4H)-acetic acid, 2-(1,1-dimethylethyl)tetrahydro-.alpha.-methyl-4-oxo-, methyl ester, [2S-[2.alpha.,4a.beta.(S*),7a.beta.]]-
CAS Registry Number 124989-41-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H24O5
InChI InChI=1S/C15H24O5/c1-9(11(16)18-5)15-8-6-7-10(15)19-13(14(2,3)4)20-12(15)17/h9-10,13H,6-8H2,1-5H3/t9?,10-,13-,15?/m0/s1
InChIKey ZTGWTEBGHRCZJH-JTMGSUHQSA-N
Molecular Weight 284.352 g/mol
SMILES C12(C(O[C@](O[C@]2(CCC1)[H])(C(C)(C)C)[H])=O)C(C(=O)OC)C
SPLASH splash10-052f-9300000000-18536af9834a0fc00848
Source of Spectrum H-72-703-5
Synonyms Methyl (2S,4aS,7aS)-2-(t-butyl)-4,4a,5,6,7,7a-hexahydro-4-oxocyclopenta[d]dioxine-4a-methylacetate Methyl 2-((2S,7aS)-2-tert-butyl-4-oxotetrahydrocyclopenta[d][1,3]dioxin-4a(4H)-yl)propanoate
Wiley ID 1287784