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(S)-1-(1-Allyl-2,2-ethylenedioxycyclohexan-1-yl)but-3-en-1-one
SpectraBase Compound ID 2LSkmT5W8Rg
InChI InChI=1S/C15H22O3/c1-3-7-13(16)14(8-4-2)9-5-6-10-15(14)17-11-12-18-15/h3-4H,1-2,5-12H2/t14-/m1/s1
InChIKey TWKJCEPNLNNEJV-CQSZACIVSA-N
Mol Weight 250.34 g/mol
Molecular Formula C15H22O3
Exact Mass 250.156895 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4UFRwgVxMO
Name (S)-1-(1-Allyl-2,2-ethylenedioxycyclohexan-1-yl)but-3-en-1-one
Alternate Name(s) 1-(1-Allyl-2,2-ethylenedioxycyclohexan-1-yl)but-3-en-1-one 1-[(6S)-6-allyl-1,4-dioxaspiro[4.5]dec-6-yl]-3-buten-1-one
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Formula C15H22O3
InChI InChI=1S/C15H22O3/c1-3-7-13(16)14(8-4-2)9-5-6-10-15(14)17-11-12-18-15/h3-4H,1-2,5-12H2/t14-/m1/s1
InChIKey TWKJCEPNLNNEJV-CQSZACIVSA-N
Molecular Weight 250.338 g/mol
SMILES [C@@]1(C2(OCCO2)CCCC1)(C(=O)CC=C)CC=C
SPLASH splash10-053b-9400000000-fec5ff6e72b5635adfc1
Source of Spectrum K-2001-1467-19
Wiley ID 1579169