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5-Formyl[3.2]paracyclophane
SpectraBase Compound ID 3OLW0LcCJ7J
InChI InChI=1S/C18H18O/c19-13-18-12-16-9-8-15-6-4-14(5-7-15)2-1-3-17(18)11-10-16/h4-7,10-13H,1-3,8-9H2
InChIKey RFKPRQGFWNJKSJ-UHFFFAOYSA-N
Mol Weight 250.34 g/mol
Molecular Formula C18H18O
Exact Mass 250.135765 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3o9gzil1Eri
Name 5-Formyl[3.2]paracyclophane
Alternate Name(s) Tricyclo[9.2.2.2*4,7*]heptadeca-1(14),4(17),5,7(16),11(15),12-hexaene-6-carbaldehyde
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Formula C18H18O
InChI InChI=1S/C18H18O/c19-13-18-12-16-9-8-15-6-4-14(5-7-15)2-1-3-17(18)11-10-16/h4-7,10-13H,1-3,8-9H2
InChIKey RFKPRQGFWNJKSJ-UHFFFAOYSA-N
Molecular Weight 250.341 g/mol
SMILES c1(c2ccc(c1)CCc1ccc(CCC2)cc1)C=O
SPLASH splash10-0gb9-0930000000-5c75ec5da773c86cd9af
Source of Spectrum U1-2009-234-28
Wiley ID 1662385