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[4,8-Bis(decyloxy)-5-(4-fluorobenzoyl)naphthalene, 1-(4-fluorobenzoyl)-
SpectraBase Compound ID Ee6q21UwYii
InChI InChI=1S/C44H54F2O4/c1-3-5-7-9-11-13-15-17-31-49-39-29-27-38(44(48)34-21-25-36(46)26-22-34)42-40(50-32-18-16-14-12-10-8-6-4-2)30-28-37(41(39)42)43(47)33-19-23-35(45)24-20-33/h19-30H,3-18,31-32H2,1-2H3
InChIKey NVMVQSCKUVHMSS-UHFFFAOYSA-N
Mol Weight 684.9 g/mol
Molecular Formula C44H54F2O4
Exact Mass 684.399017 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Lf4zq6r5yZs
Name [4,8-Bis(decyloxy)-5-(4-fluorobenzoyl)naphthalene, 1-(4-fluorobenzoyl)-
CAS Registry Number 148341-00-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C44H54F2O4
InChI InChI=1S/C44H54F2O4/c1-3-5-7-9-11-13-15-17-31-49-39-29-27-38(44(48)34-21-25-36(46)26-22-34)42-40(50-32-18-16-14-12-10-8-6-4-2)30-28-37(41(39)42)43(47)33-19-23-35(45)24-20-33/h19-30H,3-18,31-32H2,1-2H3
InChIKey NVMVQSCKUVHMSS-UHFFFAOYSA-N
Molecular Weight 684.909 g/mol
SMILES c1c(ccc(C(c2ccc(c3c(ccc(c23)OCCCCCCCCCC)C(=O)c2ccc(cc2)F)OCCCCCCCCCC)=O)c1)F
SPLASH splash10-053f-9223214000-ccbde8c76f555bffdf60
Synonyms [4,8-didecoxy-5-(4-fluorobenzoyl)-1-naphthyl]-(4-fluorophenyl)methanone [4,8-didecoxy-5-(4-fluorobenzoyl)naphthalen-1-yl]-(4-fluorophenyl)methanone [4,8-didecoxy-5-(4-fluorophenyl)carbonyl-naphthalen-1-yl]-(4-fluorophenyl)methanone [4,8-didecoxy-5-[(4-fluorophenyl)-oxomethyl]-1-naphthalenyl]-(4-fluorophenyl)methanone
Wiley ID 1474914