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3,4,5-Trimethoxybenzoic acid, ester with alpha-methyl-4-(3,4,5-trimethoxybenzoyl)-1-piperazineethanol, hydrochloride
SpectraBase Compound ID BFz2NfQhEBd
InChI InChI=1S/C27H36N2O9.ClH/c1-17(38-27(31)19-14-22(34-4)25(37-7)23(15-19)35-5)16-28-8-10-29(11-9-28)26(30)18-12-20(32-2)24(36-6)21(13-18)33-3;/h12-15,17H,8-11,16H2,1-7H3;1H
InChIKey OLWQKSDKYHVLAF-UHFFFAOYSA-N
Mol Weight 569.1 g/mol
Molecular Formula C27H37ClN2O9
Exact Mass 568.218758 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID J5Xfog3cxLJ
Name 3,4,5-TRIMETHOXYBENZOIC ACID, ESTER WITH alpha-METHYL-4-(3,4,5-TRIMETHOXYBENZOYL)-1-PIPERAZINEETHANOL, HYDROCHLORIDE
Source of Sample L. TOLDY, RESEARCH INSTITUTE FOR PHARMACEUTICAL CHEMISTRY, BUDAPEST, HUNGARY
Copyright Copyright © 1980, 1981-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H37ClN2O9
InChI InChI=1S/C27H36N2O9.ClH/c1-17(38-27(31)19-14-22(34-4)25(37-7)23(15-19)35-5)16-28-8-10-29(11-9-28)26(30)18-12-20(32-2)24(36-6)21(13-18)33-3;/h12-15,17H,8-11,16H2,1-7H3;1H
InChIKey OLWQKSDKYHVLAF-UHFFFAOYSA-N
Literature Reference Abstract-Chemical Abstracts= 61, 13308(1964)
Melting Point 173-175C
Molecular Weight 569.047974
Synonyms BENZOIC ACID, 3,4,5-TRIMETHOXY-, ESTER WITH A-METHYL-4-/3,4,5-TRI- METHOXYBENZOYL/-1-PIPERAZINEETHANOL, HYDROCHLORIDE 1-PIPERAZINEETHANOL, A-METHYL-4- /3,4,5-TRIMETHOXYBENZOYL/-, 3,4,5- TRIMETHOXYBENZOATE, HYDROCHLORIDE
Technique KBr WAFER