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DHCHYFXKUUNOKT-QGMBQPNBSA-N
SpectraBase Compound ID 4ezbZXEqj8D
InChI InChI=1S/C26H35ClO5/c1-18(7-5-9-19(2)13-25(29)26(20(3)27)32-21(4)28)8-6-10-22-14-24(31-17-22)15-23-11-12-30-16-23/h8,11-12,14,16-17,19-20,26H,5-7,9-10,13,15H2,1-4H3/b18-8+
InChIKey DHCHYFXKUUNOKT-QGMBQPNBSA-N
Mol Weight 463.0 g/mol
Molecular Formula C26H35ClO5
Exact Mass 462.217302 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 802TGGyrc32
Name 5-(3'-Furanyl)-3-[4",8"-dimethyl-10"-oxo-11"-acetoxy-12"-chlorotridec-3"-en-11"-yl]-furan
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H35ClO5
InChI InChI=1S/C26H35ClO5/c1-18(7-5-9-19(2)13-25(29)26(20(3)27)32-21(4)28)8-6-10-22-14-24(31-17-22)15-23-11-12-30-16-23/h8,11-12,14,16-17,19-20,26H,5-7,9-10,13,15H2,1-4H3/b18-8+
InChIKey DHCHYFXKUUNOKT-QGMBQPNBSA-N
Molecular Weight 463.014 g/mol
SMILES C(C(CC(CCC\C(=C\CCc1cc(Cc2cocc2)oc1)C)C)=O)(OC(=O)C)C(Cl)C
SPLASH splash10-03di-0910500000-53705d7ec07ebebeb8da
Source of Spectrum X2-53-1506-2
Synonyms (8E)-1-(1-chloroethyl)-11-[5-(3-furylmethyl)-3-furyl]-4,8-dimethyl-2-oxo-8-undecenyl acetate
Wiley ID 1603828