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5-tert-Butyl-8-ethenyl[2.2]metacyclophane
SpectraBase Compound ID YuIBgohNVd
InChI InChI=1S/C22H26/c1-5-21-18-11-9-16-7-6-8-17(13-16)10-12-19(21)15-20(14-18)22(2,3)4/h5-8,13-15H,1,9-12H2,2-4H3
InChIKey XNPLDGUEVDCQDW-UHFFFAOYSA-N
Mol Weight 290.45 g/mol
Molecular Formula C22H26
Exact Mass 290.203451 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ahp0GfnJgIE
Name 5-tert-Butyl-8-ethenyl[2.2]metacyclophane
Comments Less than 3 mono-isotopic peaks
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Formula C22H26
InChI InChI=1S/C22H26/c1-5-21-18-11-9-16-7-6-8-17(13-16)10-12-19(21)15-20(14-18)22(2,3)4/h5-8,13-15H,1,9-12H2,2-4H3
InChIKey XNPLDGUEVDCQDW-UHFFFAOYSA-N
Molecular Weight 290.450 g/mol
SMILES c1(cc2CCc3cccc(c3)CCc(c1)c2C=C)C(C)(C)C
SPLASH splash10-000i-0940000000-7fd19b22ed15724fc8b9
Source of Spectrum J-61-5107-2
Synonyms 6-tert-butyl-16-vinyltricyclo[9.3.1.1(4,8)]hexadeca-1(15),4(16),5,7,11,13-hexaene
Wiley ID 1294266