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4-Methoxycarbonyl-13-(2-methoxyphenyl)[2.2]paracyclophane
SpectraBase Compound ID J7PnMPiyVIy
InChI InChI=1S/C25H24O3/c1-27-24-6-4-3-5-21(24)22-15-17-7-8-18-10-12-20(14-13-19(22)11-9-17)23(16-18)25(26)28-2/h3-6,9-12,15-16H,7-8,13-14H2,1-2H3
InChIKey WKIRVCBEUFHIAW-UHFFFAOYSA-N
Mol Weight 372.46 g/mol
Molecular Formula C25H24O3
Exact Mass 372.172545 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5ZsC2z6bwBh
Name 4-Methoxycarbonyl-13-(2-methoxyphenyl)[2.2]paracyclophane
Alternate Name(s) 13-(2-Methoxyphenyl)tricyclo[8.2.2.24,7]hexadeca-1(13),4,6,10(14),11,15-hexaene-5-carboxylic acid, methyl ester Methyl 12-(2-methoxyphenyl)tricyclo[8.2.2.2(4,7)]hexadeca-1(12),4,6,10,13,15-hexaene-5-carboxylate
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Formula C25H24O3
InChI InChI=1S/C25H24O3/c1-27-24-6-4-3-5-21(24)22-15-17-7-8-18-10-12-20(14-13-19(22)11-9-17)23(16-18)25(26)28-2/h3-6,9-12,15-16H,7-8,13-14H2,1-2H3
InChIKey WKIRVCBEUFHIAW-UHFFFAOYSA-N
Molecular Weight 372.464 g/mol
SMILES c1(-c2c(OC)cccc2)c2CCc3c(C(=O)OC)cc(CCc(c1)cc2)cc3
SPLASH splash10-06vj-0931000000-5aa2d596486e56ea539c
Source of Spectrum Y1-44-3804-18
Wiley ID 1621533