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(E)-(4aS,13aR)-3,4,4a,6,7,8,9,10,13a-Decahydro-2H-1,5-dioxabenzocycloundecadecene
SpectraBase Compound ID 5Y25A1KdspA
InChI InChI=1S/C13H22O2/c1-2-4-6-10-14-13-9-7-11-15-12(13)8-5-3-1/h5,8,12-13H,1-4,6-7,9-11H2/b8-5+/t12-,13+/m1/s1
InChIKey KMPRTBSOWVENJK-FMQXYTONSA-N
Mol Weight 210.32 g/mol
Molecular Formula C13H22O2
Exact Mass 210.16198 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BNOj5hio4BD
Name (E)-(4aS,13aR)-3,4,4a,6,7,8,9,10,13a-Decahydro-2H-1,5-dioxabenzocycloundecadecene
Comments Less than 3 mono-isotopic peaks
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Formula C13H22O2
InChI InChI=1S/C13H22O2/c1-2-4-6-10-14-13-9-7-11-15-12(13)8-5-3-1/h5,8,12-13H,1-4,6-7,9-11H2/b8-5+/t12-,13+/m1/s1
InChIKey KMPRTBSOWVENJK-FMQXYTONSA-N
Molecular Weight 210.317 g/mol
SMILES [C@@]12(OCCC[C@@]1(OCCCCCC\C=C\2)[H])[H]
SPLASH splash10-03di-0290000000-c747a240c325d0742f8c
Source of Spectrum J-64-4812-34
Wiley ID 1530581