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(-)-(E)-(1S,6R)-8,8-Dimethyl-3-formyl-4-propylidene-7,9-dioxabicyclo[4.3.0]non-2-ene
SpectraBase Compound ID 5EKMnNT9bBP
InChI InChI=1S/C13H18O3/c1-4-5-9-6-11-12(7-10(9)8-14)16-13(2,3)15-11/h5,7-8,11-12H,4,6H2,1-3H3/b9-5-/t11-,12+/m1/s1
InChIKey XDTOKYHXKWURJI-SGLQCISKSA-N
Mol Weight 222.28 g/mol
Molecular Formula C13H18O3
Exact Mass 222.125594 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DcjVAeYAkIn
Name (-)-(E)-(1S,6R)-8,8-Dimethyl-3-formyl-4-propylidene-7,9-dioxabicyclo[4.3.0]non-2-ene
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Formula C13H18O3
InChI InChI=1S/C13H18O3/c1-4-5-9-6-11-12(7-10(9)8-14)16-13(2,3)15-11/h5,7-8,11-12H,4,6H2,1-3H3/b9-5-/t11-,12+/m1/s1
InChIKey XDTOKYHXKWURJI-SGLQCISKSA-N
Molecular Weight 222.284 g/mol
SMILES C1(=C[C@@]2(OC(C)(C)O[C@@]2(C\C1=C/CC)[H])[H])C=O
SPLASH splash10-03dj-0900000000-589830ca75bb144b75b8
Source of Spectrum J-59-5608-49
Synonyms (3aS,6Z,7aR)-2,2-dimethyl-6-propylidene-3a,6,7,7a-tetrahydro-1,3-benzodioxole-5-carbaldehyde
Wiley ID 1222669