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2-[2-(4-Fluorophenyl)methyl-4,4-dimethyl-2-cyclopenten-1-yl]-1-phenylethanone
SpectraBase Compound ID DR7UkXKyt5G
InChI InChI=1S/C22H23FO/c1-22(2)14-18(12-16-8-10-20(23)11-9-16)19(15-22)13-21(24)17-6-4-3-5-7-17/h3-11,14,19H,12-13,15H2,1-2H3
InChIKey COBWWDQNKQXVPJ-UHFFFAOYSA-N
Mol Weight 322.42 g/mol
Molecular Formula C22H23FO
Exact Mass 322.173294 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DnVe3lbNz5g
Name 2-[2-(4-Fluorophenyl)methyl-4,4-dimethyl-2-cyclopenten-1-yl]-1-phenylethanone
Alternate Name(s) 2-(2-(4-fluorobenzyl)-4,4-dimethylcyclopent-2-en-1-yl)-1-phenylethanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H23FO
InChI InChI=1S/C22H23FO/c1-22(2)14-18(12-16-8-10-20(23)11-9-16)19(15-22)13-21(24)17-6-4-3-5-7-17/h3-11,14,19H,12-13,15H2,1-2H3
InChIKey COBWWDQNKQXVPJ-UHFFFAOYSA-N
Literature Reference DOI 10.1021/ol800509z
Molecular Weight 322.423 g/mol
SMILES C1(C=C(Cc2ccc(cc2)F)C(CC(c2ccccc2)=O)C1)(C)C
SPLASH splash10-0a4i-1922000000-3bcd0dfc0300e5ecc10a
Source of Spectrum A1-10-2633/SMS11-8f
Wiley ID 1759396