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10-(1',3'-Benzodioxol-5'-yl)-9-[(methylsulfonyl)oxy]-decan-5-one
SpectraBase Compound ID Bf00fn3x6yt
InChI InChI=1S/C18H26O6S/c1-3-4-6-15(19)7-5-8-16(24-25(2,20)21)11-14-9-10-17-18(12-14)23-13-22-17/h9-10,12,16H,3-8,11,13H2,1-2H3
InChIKey LCEITPIAQTVWSD-UHFFFAOYSA-N
Mol Weight 370.46 g/mol
Molecular Formula C18H26O6S
Exact Mass 370.14501 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BHuCzuc5MbK
Name 10-(1',3'-Benzodioxol-5'-yl)-9-[(methylsulfonyl)oxy]-decan-5-one
Alternate Name(s) 1-(1,3-benzodioxol-5-ylmethyl)-5-oxononyl methanesulfonate
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Formula C18H26O6S
InChI InChI=1S/C18H26O6S/c1-3-4-6-15(19)7-5-8-16(24-25(2,20)21)11-14-9-10-17-18(12-14)23-13-22-17/h9-10,12,16H,3-8,11,13H2,1-2H3
InChIKey LCEITPIAQTVWSD-UHFFFAOYSA-N
Molecular Weight 370.460 g/mol
SMILES C(OS(=O)(=O)C)(Cc1cc2OCOc2cc1)CCCC(=O)CCCC
SPLASH splash10-00dr-2900000000-13f24688f90fa38c16f7
Source of Spectrum H-84-171-13
Wiley ID 847420