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1,3-Cyclopentanedione, 2-[2-(3,4-dihydro-6-methoxy-1(2H)-naphthalenylidene)ethyl]-2-(trifluoromethyl)-
SpectraBase Compound ID 3ANAenq3E96
InChI InChI=1S/C19H19F3O3/c1-25-14-5-6-15-12(3-2-4-13(15)11-14)9-10-18(19(20,21)22)16(23)7-8-17(18)24/h5-6,9,11H,2-4,7-8,10H2,1H3/b12-9+
InChIKey PWUACLBUSCCLCL-FMIVXFBMSA-N
Mol Weight 352.35 g/mol
Molecular Formula C19H19F3O3
Exact Mass 352.128629 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4qJtKLAZzHT
Name 1,3-Cyclopentanedione, 2-[2-(3,4-dihydro-6-methoxy-1(2H)-naphthalenylidene)ethyl]-2-(trifluoromethyl)-
CAS Registry Number 854-99-9
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H19F3O3
InChI InChI=1S/C19H19F3O3/c1-25-14-5-6-15-12(3-2-4-13(15)11-14)9-10-18(19(20,21)22)16(23)7-8-17(18)24/h5-6,9,11H,2-4,7-8,10H2,1H3/b12-9+
InChIKey PWUACLBUSCCLCL-FMIVXFBMSA-N
Molecular Weight 352.353 g/mol
SMILES C1(C(F)(F)F)(C\C=C\2c3c(cc(cc3)OC)CCC2)C(CCC1=O)=O
SPLASH splash10-000i-0903000000-c02c4acb7686ec8844eb
Source of Spectrum KC-1986-339-3
Synonyms 1,3-Cyclopentanedione, 2-[2-(3,4-dihydro-6-methoxy-1(2H)-naphthylidene)ethyl]-2-(trifluoromethyl)- 2-[(2E)-2-(6-methoxy-3,4-dihydro-1(2H)-naphthalenylidene)ethyl]-2-(trifluoromethyl)-1,3-cyclopentanedione 2-{2-[3,4-dihydro-6-methoxy-1(2H)naphthylidene]ethyl}-2-trifluoromethylcyclopentane-1,3-dione
Wiley ID 1343178