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Methyl 7-[2'-methyl-6'-oxohexahydrocyclopenta-[1,3](4H)-dioxin-5'-yl]-heptanoate
SpectraBase Compound ID 8QTFiM9vTEY
InChI InChI=1S/C16H26O5/c1-11-20-10-13-12(14(17)9-15(13)21-11)7-5-3-4-6-8-16(18)19-2/h11-13,15H,3-10H2,1-2H3/t11-,12+,13+,15+/m0/s1
InChIKey GLUQPNAIDABGBD-KYEXWDHISA-N
Mol Weight 298.38 g/mol
Molecular Formula C16H26O5
Exact Mass 298.178024 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DmDcnAxSLDa
Name Methyl 7-[2'-methyl-6'-oxohexahydrocyclopenta-[1,3](4H)-dioxin-5'-yl]-heptanoate
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H26O5
InChI InChI=1S/C16H26O5/c1-11-20-10-13-12(14(17)9-15(13)21-11)7-5-3-4-6-8-16(18)19-2/h11-13,15H,3-10H2,1-2H3/t11-,12+,13+,15+/m0/s1
InChIKey GLUQPNAIDABGBD-KYEXWDHISA-N
Molecular Weight 298.379 g/mol
SMILES [C@]12([C@@]([C@@](CCCCCCC(=O)OC)(C(C2)=O)[H])(CO[C@@](O1)(C)[H])[H])[H]
SPLASH splash10-0a4j-9310000000-b5ff3e47ea2fc39c7aa1
Source of Spectrum G-61-1517-15
Synonyms 7-((2S,4aS,5R,7aR)-2-Methyl-6-oxo-hexahydro-cyclopenta[1,3]dioxin-5-yl)-heptanoic acid methyl ester
Wiley ID 749077