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Isopropyl 4-(2-chloroethyl)-1-hydroxy-3,5-diethyl-2-benzoate
SpectraBase Compound ID BBy0TLUjEDB
InChI InChI=1S/C16H23ClO3/c1-5-11-9-14(18)15(16(19)20-10(3)4)12(6-2)13(11)7-8-17/h9-10,18H,5-8H2,1-4H3
InChIKey VEECUQXZHMNUQF-UHFFFAOYSA-N
Mol Weight 298.81 g/mol
Molecular Formula C16H23ClO3
Exact Mass 298.133572 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8TSmdkN3rvJ
Name Isopropyl 4-(2-chloroethyl)-1-hydroxy-3,5-diethyl-2-benzoate
Alternate Name(s) 3-(2-Chloroethyl)-2,4-diethyl-6-hydroxybenzoic acid propan-2-yl ester Propan-2-yl 3-(2-chloroethyl)-2,4-diethyl-6-hydroxybenzoate isopropyl 3-(2-chloroethyl)-2,4-diethyl-6-hydroxy-benzoate Propan-2-yl 3-(2-chloroethyl)-2,4-diethyl-6-oxidanyl-benzoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H23ClO3
InChI InChI=1S/C16H23ClO3/c1-5-11-9-14(18)15(16(19)20-10(3)4)12(6-2)13(11)7-8-17/h9-10,18H,5-8H2,1-4H3
InChIKey VEECUQXZHMNUQF-UHFFFAOYSA-N
Molecular Weight 298.810 g/mol
SMILES Oc1c(C(OC(C)C)=O)c(c(CCCl)c(c1)CC)CC
SPLASH splash10-000i-2590000000-a3dc269f85828d95bb71
Source of Spectrum F-69-9132-3
Wiley ID 1595968