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1-Octyl-2,2-diphenoxy-1-(phenylsulfonyl)cyclopropane
SpectraBase Compound ID LtzyVZeJ3SP
InChI InChI=1S/C29H34O4S/c1-2-3-4-5-6-16-23-28(34(30,31)27-21-14-9-15-22-27)24-29(28,32-25-17-10-7-11-18-25)33-26-19-12-8-13-20-26/h7-15,17-22H,2-6,16,23-24H2,1H3
InChIKey MSDFKNJENGWFLI-UHFFFAOYSA-N
Mol Weight 478.6 g/mol
Molecular Formula C29H34O4S
Exact Mass 478.217781 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID D9AAJVCVabT
Name 1-Octyl-2,2-diphenoxy-1-(phenylsulfonyl)cyclopropane
Alternate Name(s) 1-Octyl-2,2-diphenoxycyclopropyl phenyl sulfone [(1-octyl-2,2-diphenoxycyclopropyl)sulfonyl]benzene
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Formula C29H34O4S
InChI InChI=1S/C29H34O4S/c1-2-3-4-5-6-16-23-28(34(30,31)27-21-14-9-15-22-27)24-29(28,32-25-17-10-7-11-18-25)33-26-19-12-8-13-20-26/h7-15,17-22H,2-6,16,23-24H2,1H3
InChIKey MSDFKNJENGWFLI-UHFFFAOYSA-N
Molecular Weight 478.647 g/mol
SMILES C1(C(Oc2ccccc2)(Oc2ccccc2)C1)(S(=O)(=O)c1ccccc1)CCCCCCCC
SPLASH splash10-004u-9354000000-13c561854b5353f08c2f
Source of Spectrum F-49-6479-6
Wiley ID 1394845