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Methanone, [4'-(1-naphthalenyl)[1,1'-bibicyclo[2.2.2]octan]-4-yl]phenyl-
SpectraBase Compound ID 741x8u62Mdc
InChI InChI=1S/C33H36O/c34-29(26-8-2-1-3-9-26)31-16-22-33(23-17-31,24-18-31)32-19-13-30(14-20-32,15-21-32)28-12-6-10-25-7-4-5-11-27(25)28/h1-12H,13-24H2
InChIKey UCTINAZVMLCTLT-UHFFFAOYSA-N
Mol Weight 448.7 g/mol
Molecular Formula C33H36O
Exact Mass 448.276616 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 56ePCeWUTM5
Name Methanone, [4'-(1-naphthalenyl)[1,1'-bibicyclo[2.2.2]octan]-4-yl]phenyl-
Alternate Name(s) 4-(4'-(.alpha.-naphthyl)-1,1'-bibicyclo(2.2.2)octyl)yl phenyl ketone {4-[4-(naphthalen-1-yl)bicyclo[2.2.2]octan-1-yl]bicyclo[2.2.2]octan-1-yl}(phenyl)methanone
CAS Registry Number 74467-46-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C33H36O
InChI InChI=1S/C33H36O/c34-29(26-8-2-1-3-9-26)31-16-22-33(23-17-31,24-18-31)32-19-13-30(14-20-32,15-21-32)28-12-6-10-25-7-4-5-11-27(25)28/h1-12H,13-24H2
InChIKey UCTINAZVMLCTLT-UHFFFAOYSA-N
Molecular Weight 448.650 g/mol
SMILES C12(C34CCC(CC4)(c4c5c(cccc5)ccc4)CC3)CCC(CC2)(C(=O)c2ccccc2)CC1
SPLASH splash10-0002-0800900000-00334f4720a97f1ae205
Source of Spectrum J-45-3948-0
Wiley ID 1387381