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[t-5-methyl-10-(methoxymethylene)-6-oxo-c-4-[(2-tetrahydropyranyl)oxy]-r-1H-bi- cyclo[5.3.0]dec-7-yl]acetic acid
SpectraBase Compound ID DftGxeHMhQK
InChI InChI=1S/C20H30O6/c1-13-16(26-18-5-3-4-10-25-18)7-6-15-14(12-24-2)8-9-20(15,19(13)23)11-17(21)22/h12-13,15-16,18H,3-11H2,1-2H3,(H,21,22)/b14-12+/t13-,15-,16+,18?,20?/m1/s1
InChIKey RJDAPAAZFGOGGE-SVKAJTSOSA-N
Mol Weight 366.45 g/mol
Molecular Formula C20H30O6
Exact Mass 366.204239 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5yOxNCtsLPc
Name [t-5-methyl-10-(methoxymethylene)-6-oxo-c-4-[(2-tetrahydropyranyl)oxy]-r-1H-bi- cyclo[5.3.0]dec-7-yl]acetic acid
CAS Registry Number 71838-33-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H30O6
InChI InChI=1S/C20H30O6/c1-13-16(26-18-5-3-4-10-25-18)7-6-15-14(12-24-2)8-9-20(15,19(13)23)11-17(21)22/h12-13,15-16,18H,3-11H2,1-2H3,(H,21,22)/b14-12+/t13-,15-,16+,18?,20?/m1/s1
InChIKey RJDAPAAZFGOGGE-SVKAJTSOSA-N
Molecular Weight 366.454 g/mol
SMILES OC(CC12C([C@@]([C@@](OC3OCCCC3)(CC[C@@]1(\C(=C\OC)CC2)[H])[H])(C)[H])=O)=O
SPLASH splash10-0a4r-9010000000-031fa342c96354afa9ac
Source of Spectrum J-44-4866-0
Synonyms ((1E,5R,6S,8aR)-1-(methoxymethylene)-5-methyl-4-oxo-6-(tetrahydro-2H-pyran-2-yloxy)octahydro-3a(1H)-azulenyl)acetic acid
Wiley ID 1351946