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Methyl 7-[6'-hydroxy-2'-methylhexahydrocyclopenta-[1,3](4H)-dioxin-5'-yl]-heptanoate
SpectraBase Compound ID L3RBRoWpDhQ
InChI InChI=1S/C16H28O5/c1-11-20-10-13-12(14(17)9-15(13)21-11)7-5-3-4-6-8-16(18)19-2/h11-15,17H,3-10H2,1-2H3/t11-,12+,13+,14-,15+/m0/s1
InChIKey IYLOAKFMXHMFLH-VYDRJRHOSA-N
Mol Weight 300.39 g/mol
Molecular Formula C16H28O5
Exact Mass 300.193674 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LO2ysF20z0y
Name Methyl 7-[6'-hydroxy-2'-methylhexahydrocyclopenta-[1,3](4H)-dioxin-5'-yl]-heptanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H28O5
InChI InChI=1S/C16H28O5/c1-11-20-10-13-12(14(17)9-15(13)21-11)7-5-3-4-6-8-16(18)19-2/h11-15,17H,3-10H2,1-2H3/t11-,12+,13+,14-,15+/m0/s1
InChIKey IYLOAKFMXHMFLH-VYDRJRHOSA-N
Molecular Weight 300.395 g/mol
SMILES O[C@]1(C[C@@]2([C@@]([C@]1(CCCCCCC(=O)OC)[H])(CO[C@@](O2)(C)[H])[H])[H])[H]
SPLASH splash10-0002-9420000000-e030b073118916a2b24e
Source of Spectrum G-61-1517-14
Synonyms 7-((2S,4aS,5R,6S,7aR)-6-Hydroxy-2-methyl-hexahydro-cyclopenta[1,3]dioxin-5-yl)-heptanoic acid methyl ester
Wiley ID 749078