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3,4,5-trimethoxybenzoic acid, ester with 2-chloro-10-{2-[4-(2-hydroxyethyl)-1-piperazinyl]propionyl}phenothiazine, dioxalate

View entire compound with spectra: 1 FTIR, and 1 UV-Vis

3,4,5-trimethoxybenzoic acid, ester with 2-chloro-10-{2-[4-(2-hydroxyethyl)-1-piperazinyl]propionyl}phenothiazine, dioxalate
SpectraBase Compound ID JD57QQz3V00
InChI InChI=1S/C31H34ClN3O6S.2C2H2O4/c1-20(30(36)35-23-7-5-6-8-27(23)42-28-10-9-22(32)19-24(28)35)34-13-11-33(12-14-34)15-16-41-31(37)21-17-25(38-2)29(40-4)26(18-21)39-3;2*3-1(4)2(5)6/h5-10,17-20H,11-16H2,1-4H3;2*(H,3,4)(H,5,6)
InChIKey YRZCAPWQMBCGAP-UHFFFAOYSA-N
Mol Weight 792.21 g/mol
Molecular Formula C35H38ClN3O14S
Exact Mass 791.176302 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID 6UnUTFxr045
Name 3,4,5-TRIMETHOXYBENZOIC ACID, ESTER WITH 2-CHLORO-10-{2-[4-(2-HYDROXYETHYL)-1-PIPERAZINYL]PROPIONYL}PHENOTHIAZINE, DIOXALATE
Source of Sample L. TOLDY, RESEARCH INSTITUTE FOR PHARMACEUTICAL CHEMISTRY, BUDAPEST, HUNGARY
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C35H38ClN3O14S
InChI InChI=1S/C31H34ClN3O6S.2C2H2O4/c1-20(30(36)35-23-7-5-6-8-27(23)42-28-10-9-22(32)19-24(28)35)34-13-11-33(12-14-34)15-16-41-31(37)21-17-25(38-2)29(40-4)26(18-21)39-3;2*3-1(4)2(5)6/h5-10,17-20H,11-16H2,1-4H3;2*(H,3,4)(H,5,6)
InChIKey YRZCAPWQMBCGAP-UHFFFAOYSA-N
Literature Reference Abstract-Chemical Abstracts= 63, 14853(1965)
Melting Point 192-194C
Molecular Weight 792.205994
Synonyms 1-PIPERAZINEETHANOL, 4-/1-//2-CHLOROPHENOTHIAZIN-10-YL/CARBONYL/ETHYL/-, 3,4,5-TRIMETHOXYBENZOATE /ESTER/, OXALATE /1.2/ BENZOIC ACID, 3,4,5-TRIMETHOXY-, ESTER WITH 2-CHLORO-10-/2-/4-/2- HYDROXYETHYL/-1-PIPERAZINYL/PROPIONYL/- PHENOTHIAZINE, OXALATE /1.2/
Technique KBr WAFER