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25-Chloro-25-(4'-[2.2.2]paracyclophanyl)ethene
SpectraBase Compound ID 1vVs8ebO5tP
InChI InChI=1S/C26H25Cl/c1-19(27)26-18-24-13-12-22-6-4-20(5-7-22)2-3-21-8-10-23(11-9-21)14-16-25(26)17-15-24/h4-11,15,17-18H,1-3,12-14,16H2
InChIKey ZCXOBKZQSGECLA-UHFFFAOYSA-N
Mol Weight 372.94 g/mol
Molecular Formula C26H25Cl
Exact Mass 372.164479 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FqtqDP5OWDE
Name 25-Chloro-25-(4'-[2.2.2]paracyclophanyl)ethene
Comments Less than 3 mono-isotopic peaks
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Formula C26H25Cl
InChI InChI=1S/C26H25Cl/c1-19(27)26-18-24-13-12-22-6-4-20(5-7-22)2-3-21-8-10-23(11-9-21)14-16-25(26)17-15-24/h4-11,15,17-18H,1-3,12-14,16H2
InChIKey ZCXOBKZQSGECLA-UHFFFAOYSA-N
Molecular Weight 372.939 g/mol
SMILES c1(C(=C)Cl)c2CCc3ccc(cc3)CCc3ccc(CCc(c1)cc2)cc3
SPLASH splash10-000i-0009000000-f1abdba5c37f53870e40
Source of Spectrum U-1995-1526-11
Wiley ID 767306