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4,12-Divinyl[2.2]paracyclophane
SpectraBase Compound ID JMrmw94CHec
InChI InChI=1S/C20H20/c1-3-17-13-15-5-9-19(17)11-7-16-6-10-20(12-8-15)18(4-2)14-16/h3-6,9-10,13-14H,1-2,7-8,11-12H2
InChIKey TTXZIYBDKNEJBG-UHFFFAOYSA-N
Mol Weight 260.38 g/mol
Molecular Formula C20H20
Exact Mass 260.156501 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4Y4FoeApYWF
Name 4,12-Divinyl[2.2]paracyclophane
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 260.156500644 u
Formula C20H20
InChI InChI=1S/C20H20/c1-3-17-13-15-5-9-19(17)11-7-16-6-10-20(12-8-15)18(4-2)14-16/h3-6,9-10,13-14H,1-2,7-8,11-12H2
InChIKey TTXZIYBDKNEJBG-UHFFFAOYSA-N
Molecular Weight 260.380 g/mol
SMILES C1(=C2C=CC(=C1)CCC=1C(C=C)=CC(CC2)=CC1)C=C