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(rac)-4-Formyl[2.2]paracyclophane
SpectraBase Compound ID 81QcQQ9e9g4
InChI InChI=1S/C17H16O/c18-12-17-11-15-6-5-13-1-3-14(4-2-13)7-9-16(17)10-8-15/h1-4,8,10-12H,5-7,9H2
InChIKey BAIBHOHKSYVVCM-UHFFFAOYSA-N
Mol Weight 236.31 g/mol
Molecular Formula C17H16O
Exact Mass 236.120115 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ICjWSSUUvSQ
Name [2.2]-Paracyclophane-4-carboxaldehyde
Appearance White solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H16O
InChI InChI=1S/C17H16O/c18-12-17-11-15-6-5-13-1-3-14(4-2-13)7-9-16(17)10-8-15/h1-4,8,10-12H,5-7,9H2
InChIKey BAIBHOHKSYVVCM-UHFFFAOYSA-N
Ionization Type EI
Literature Reference DOI 10.1021/acs.joc.0c02235
Molecular Weight 236.314 g/mol
Reported Formula C17H17O
SMILES c1cc2cc(c1CCc1ccc(CC2)cc1)C=O
SPLASH splash10-0udr-2950000000-da4b3393a7096d438cc5
Source of Spectrum JOC-86-510-1
Thin-Layer Chromatography Rf = 0.59 (CH2Cl2/pentane, 80:20)
Wiley ID 1854977