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4,13-bis(phenylhydroxymethyl)[2.2]paracyclophane
SpectraBase Compound ID 8FQ8MAJU7ij
InChI InChI=1S/C30H28O2/c31-29(25-7-3-1-4-8-25)27-19-21-11-12-22-14-16-24(18-17-23(27)15-13-21)28(20-22)30(32)26-9-5-2-6-10-26/h1-10,13-16,19-20,29-32H,11-12,17-18H2
InChIKey HVNWWVOHUSABRJ-UHFFFAOYSA-N
Mol Weight 420.55 g/mol
Molecular Formula C30H28O2
Exact Mass 420.20893 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7EJ91C61NGX
Name 4,13-bis(phenylhydroxymethyl)[2.2]paracyclophane
Alternate Name(s) [12-[hydroxy(phenyl)methyl]tricyclo[8.2.2.2(4,7)]hexadeca-1(12),4,6,10,13,15-hexaen-5-yl](phenyl)methanol
CAS Registry Number 124511-93-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C30H28O2
InChI InChI=1S/C30H28O2/c31-29(25-7-3-1-4-8-25)27-19-21-11-12-22-14-16-24(18-17-23(27)15-13-21)28(20-22)30(32)26-9-5-2-6-10-26/h1-10,13-16,19-20,29-32H,11-12,17-18H2
InChIKey HVNWWVOHUSABRJ-UHFFFAOYSA-N
Molecular Weight 420.552 g/mol
SMILES OC(c1c2CCc3c(C(c4ccccc4)O)cc(CCc(c1)cc2)cc3)c1ccccc1
SPLASH splash10-0006-2900200000-541eeafb1cf3704ed28b
Source of Spectrum J-55-1362-4
Wiley ID 1378215