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3-(3,5-Dichloro-2,4,6-trimethylphenyl)-4-(2-methoxybenzyl)-5-methylisoxazole
SpectraBase Compound ID B3c3OHpAxo0
InChI InChI=1S/C21H21Cl2NO2/c1-11-18(12(2)20(23)13(3)19(11)22)21-16(14(4)26-24-21)10-15-8-6-7-9-17(15)25-5/h6-9H,10H2,1-5H3
InChIKey CEATZAIPWRPMKY-UHFFFAOYSA-N
Mol Weight 390.31 g/mol
Molecular Formula C21H21Cl2NO2
Exact Mass 389.094934 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7jBl1y6uTZX
Name 3-(3,5-Dichloro-2,4,6-trimethylphenyl)-4-(2-methoxybenzyl)-5-methylisoxazole
CAS Registry Number 70288-50-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H21Cl2NO2
InChI InChI=1S/C21H21Cl2NO2/c1-11-18(12(2)20(23)13(3)19(11)22)21-16(14(4)26-24-21)10-15-8-6-7-9-17(15)25-5/h6-9H,10H2,1-5H3
InChIKey CEATZAIPWRPMKY-UHFFFAOYSA-N
Molecular Weight 390.310 g/mol
SMILES c1(c(Cc2c(OC)cccc2)c(C)on1)-c1c(c(Cl)c(c(c1C)Cl)C)C
SPLASH splash10-0006-3009000000-7de7213a0e98cc8f64dd
Source of Spectrum J-44-2798-0
Synonyms 2-{[3-(3,5-dichloro-2,4,6-trimethylphenyl)-5-methyl-4-isoxazolyl]methyl}phenyl methyl ether
Wiley ID 1364336