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5,7-Diallyl-4-hydroxy[2.2]paracyclophane

View entire compound with spectra: 1 FTIR, and 1 MS (GC)

5,7-Diallyl-4-hydroxy[2.2]paracyclophane
SpectraBase Compound ID 1YryJKtbDyS
InChI InChI=1S/C22H24O/c1-3-5-18-15-19-13-11-16-7-9-17(10-8-16)12-14-20(18)21(6-4-2)22(19)23/h3-4,7-10,15,23H,1-2,5-6,11-14H2
InChIKey MSBFCKKYYHYLOF-UHFFFAOYSA-N
Mol Weight 304.43 g/mol
Molecular Formula C22H24O
Exact Mass 304.182715 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID K7sYdUmyaQS
Name 5,7-Diallyl-4-hydroxy[2.2]paracyclophane
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 304.182715392 u
Formula C22H24O
InChI InChI=1S/C22H24O/c1-3-5-18-15-19-13-11-16-7-9-17(10-8-16)12-14-20(18)21(6-4-2)22(19)23/h3-4,7-10,15,23H,1-2,5-6,11-14H2
InChIKey MSBFCKKYYHYLOF-UHFFFAOYSA-N
Molecular Weight 304.433 g/mol
SMILES C=1(C2=C(CC=C)C=C(C1O)CCC1=CC=C(CC2)C=C1)CC=C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.927712