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2-[5-Ethoxy-4-ethyl-3-methyl-6-(phenylsulfonyl)-4(E)-hexenyl]furan
SpectraBase Compound ID 8vUL3UDnRj5
InChI InChI=1S/C21H28O4S/c1-4-20(17(3)13-14-18-10-9-15-25-18)21(24-5-2)16-26(22,23)19-11-7-6-8-12-19/h6-12,15,17H,4-5,13-14,16H2,1-3H3/b21-20+
InChIKey DTONQRPJBRSZJV-QZQOTICOSA-N
Mol Weight 376.51 g/mol
Molecular Formula C21H28O4S
Exact Mass 376.170831 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EFW3TUPYHCp
Name 2-[5-Ethoxy-4-ethyl-3-methyl-6-(phenylsulfonyl)-4(E)-hexenyl]furan
Alternate Name(s) (2E)-2-ethoxy-3-ethyl-6-(2-furyl)-4-methyl-2-hexenyl phenyl sulfone 2-[(4E)-5-ethoxy-4-ethyl-3-methyl-6-(phenylsulfonyl)-4-hexenyl]furan
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Formula C21H28O4S
InChI InChI=1S/C21H28O4S/c1-4-20(17(3)13-14-18-10-9-15-25-18)21(24-5-2)16-26(22,23)19-11-7-6-8-12-19/h6-12,15,17H,4-5,13-14,16H2,1-3H3/b21-20+
InChIKey DTONQRPJBRSZJV-QZQOTICOSA-N
Molecular Weight 376.511 g/mol
SMILES C(S(=O)(=O)c1ccccc1)\C(=C/(C(CCc1occc1)C)CC)OCC
SPLASH splash10-001r-9510000000-dbfc94c0030d6507a6e1
Source of Spectrum J-60-5087-19
Wiley ID 1357737