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14,28-Diiodo-1,8,15,22-Tetraoxa[8.8]metacyclophane
SpectraBase Compound ID 1gSD2CfPWjD
InChI InChI=1S/C24H30I2O4/c25-23-19-11-9-13-21(23)29-17-7-3-4-8-18-30-22-14-10-12-20(24(22)26)28-16-6-2-1-5-15-27-19/h9-14H,1-8,15-18H2
InChIKey PUJOREUPTQPTIB-UHFFFAOYSA-N
Mol Weight 636.31 g/mol
Molecular Formula C24H30I2O4
Exact Mass 636.023349 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FXlEZIZEExa
Name 14,28-Diiodo-1,8,15,22-Tetraoxa[8.8]metacyclophane
Comments Less than 3 mono-isotopic peaks
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Formula C24H30I2O4
InChI InChI=1S/C24H30I2O4/c25-23-19-11-9-13-21(23)29-17-7-3-4-8-18-30-22-14-10-12-20(24(22)26)28-16-6-2-1-5-15-27-19/h9-14H,1-8,15-18H2
InChIKey PUJOREUPTQPTIB-UHFFFAOYSA-N
Molecular Weight 636.309 g/mol
SMILES c1(c2OCCCCCCOc3cccc(c3I)OCCCCCCOc1ccc2)I
SPLASH splash10-052r-0000059000-99ca6380b3b0b1e8087f
Source of Spectrum KC-0-536-8
Synonyms 27,28-Diiodo-2,9,15,22-tetraoxa-tricyclo[21.3.1.1*10,14*]octacosa-1(26),10,12,14(28),23(27),24-hexaene 27,28-diiodo-2,9,15,22-tetraoxatricyclo[21.3.1.1(10,14)]octacosa-1(27),10(28),11,13,23,25-hexaene
Wiley ID 824328