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3,4,5-trimethoxybenzoic acid, ester with 4'-chloro-2-hydroxyacetophenone
SpectraBase Compound ID GZRqjZ9yPfT
InChI InChI=1S/C18H17ClO6/c1-22-15-8-12(9-16(23-2)17(15)24-3)18(21)25-10-14(20)11-4-6-13(19)7-5-11/h4-9H,10H2,1-3H3
InChIKey KFXOCCBIXOGZDC-UHFFFAOYSA-N
Mol Weight 364.78 g/mol
Molecular Formula C18H17ClO6
Exact Mass 364.071366 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6YlHTGcx96A
Name 2-(4-Chlorophenyl)-2-oxoethyl 3,4,5-trimethoxybenzoate
Alternate Name(s) Benzoic acid, 3,4,5-trimethoxy-, 2-(4-chlorophenyl)-2-oxoethyl ester 3,4,5-trimethoxybenzoic acid [2-(4-chlorophenyl)-2-oxoethyl] ester [2-(4-chlorophenyl)-2-oxoethyl] 3,4,5-trimethoxybenzoate [2-(4-chlorophenyl)-2-oxo-ethyl] 3,4,5-trimethoxybenzoate [2-(4-chlorophenyl)-2-oxidanylidene-ethyl] 3,4,5-trimethoxybenzoate
CAS Registry Number 282730-77-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H17ClO6
InChI InChI=1S/C18H17ClO6/c1-22-15-8-12(9-16(23-2)17(15)24-3)18(21)25-10-14(20)11-4-6-13(19)7-5-11/h4-9H,10H2,1-3H3
InChIKey KFXOCCBIXOGZDC-UHFFFAOYSA-N
Molecular Weight 364.781 g/mol
SMILES c1(c(cc(cc1OC)C(OCC(c1ccc(cc1)Cl)=O)=O)OC)OC
SPLASH splash10-01ot-2903000000-00d26175509ee1491395
Source of Spectrum AD-0-2532-0
Wiley ID 1428931