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8-Oxabicyclo[5.1.0]octane-1-propanoic acid, 2,7-dimethyl-, ethyl ester, (1.alpha.,2.beta.,7.alpha.)-(.+-.)-
SpectraBase Compound ID LHpvJsVXuWa
InChI InChI=1S/C14H24O3/c1-4-16-12(15)8-10-14-11(2)7-5-6-9-13(14,3)17-14/h11H,4-10H2,1-3H3/t11-,13+,14-/m0/s1
InChIKey VMJAYFIQRCOREJ-YUTCNCBUSA-N
Mol Weight 240.34 g/mol
Molecular Formula C14H24O3
Exact Mass 240.172545 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1sPXlEuGBM
Name 8-Oxabicyclo[5.1.0]octane-1-propanoic acid, 2,7-dimethyl-, ethyl ester, (1.alpha.,2.beta.,7.alpha.)-(.+-.)-
CAS Registry Number 116536-54-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H24O3
InChI InChI=1S/C14H24O3/c1-4-16-12(15)8-10-14-11(2)7-5-6-9-13(14,3)17-14/h11H,4-10H2,1-3H3/t11-,13+,14-/m0/s1
InChIKey VMJAYFIQRCOREJ-YUTCNCBUSA-N
Molecular Weight 240.343 g/mol
SMILES [C@@]12(O[C@]2(C)CCCC[C@@]1(C)[H])CCC(=O)OCC
SPLASH splash10-0cxr-9600000000-d3320218d449150b6631
Source of Spectrum F-43-5293-9
Synonyms Ethyl 3-[(1S,2S,7R)-2,7-dimethyl-8-oxabicyclo[5.1.0]oct-1-yl]propanoate Ethyl r-3-(t-2,c-7-dimethyl-8-oxabicyclo[5.1.0]oct-1-yl)propionate
Wiley ID 1243110