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3-[5'-(Tolyl)(4'-sulfonyloxy)pentyl]cyclohex-2-enyl acetate
SpectraBase Compound ID FazPutwWElA
InChI InChI=1S/C20H28O5S/c1-16-10-12-20(13-11-16)26(22,23)24-14-5-3-4-7-18-8-6-9-19(15-18)25-17(2)21/h10-13,15,19H,3-9,14H2,1-2H3
InChIKey PDUFPCWIISLRQV-UHFFFAOYSA-N
Mol Weight 380.5 g/mol
Molecular Formula C20H28O5S
Exact Mass 380.165745 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KXFTZyDLwRV
Name 3-[5'-(Tolyl)(4'-sulfonyloxy)pentyl]cyclohex-2-enyl acetate
Alternate Name(s) 3-[5'-(Tolyl-4''-sulfonyloxy)pentyl]cyclohex-2-enyl acetate 3-[5'-(Tolyl-4''-sulfonyloxy)pentyl]cyclohex-2-enyl acetate Acetic acid 3-[5-(toluene-4-sulfonyloxy)-pentyl]-cyclohex-2-enyl ester Acetic acid [3-[5-(4-methylphenyl)sulfonyloxypentyl]-1-cyclohex-2-enyl] ester [3-[5-(4-methylphenyl)sulfonyloxypentyl]cyclohex-2-en-1-yl] acetate [3-[5-(p-tolylsulfonyloxy)pentyl]cyclohex-2-en-1-yl] acetate [3-[5-(4-methylphenyl)sulfonyloxypentyl]cyclohex-2-en-1-yl] ethanoate
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Formula C20H28O5S
InChI InChI=1S/C20H28O5S/c1-16-10-12-20(13-11-16)26(22,23)24-14-5-3-4-7-18-8-6-9-19(15-18)25-17(2)21/h10-13,15,19H,3-9,14H2,1-2H3
InChIKey PDUFPCWIISLRQV-UHFFFAOYSA-N
Molecular Weight 380.499 g/mol
SMILES c1(S(=O)(=O)OCCCCCC2=CC(OC(=O)C)CCC2)ccc(cc1)C
SPLASH splash10-000i-5309000000-943c539d76d1660a280d
Source of Spectrum K1-2000-2437-10
Wiley ID 749844