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Isopropyl 5-[2-(4-Bromophenyl)-2-chloroethyl]-4,6-dimethylsalicylate
SpectraBase Compound ID NlPGbFXrDd
InChI InChI=1S/C20H22BrClO3/c1-11(2)25-20(24)19-13(4)16(12(3)9-18(19)23)10-17(22)14-5-7-15(21)8-6-14/h5-9,11,17,23H,10H2,1-4H3
InChIKey BLFNECRQDHRRRI-UHFFFAOYSA-N
Mol Weight 425.75 g/mol
Molecular Formula C20H22BrClO3
Exact Mass 424.044085 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JUZpZ3M1tNt
Name Isopropyl 5-[2-(4-Bromophenyl)-2-chloroethyl]-4,6-dimethylsalicylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H22BrClO3
InChI InChI=1S/C20H22BrClO3/c1-11(2)25-20(24)19-13(4)16(12(3)9-18(19)23)10-17(22)14-5-7-15(21)8-6-14/h5-9,11,17,23H,10H2,1-4H3
InChIKey BLFNECRQDHRRRI-UHFFFAOYSA-N
Molecular Weight 425.750 g/mol
SMILES Oc1c(C(OC(C)C)=O)c(c(CC(c2ccc(cc2)Br)Cl)c(c1)C)C
SPLASH splash10-03mi-0940000000-ae863abff18fcfb9c9d5
Source of Spectrum U1-2010-3748-8o
Wiley ID 1663958