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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

Ultraviolet-Visible (UV-Vis) Spectrum

Ultraviolet-Visible (UV-Vis) Spectrum

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SpectraBase Spectrum ID 8Uh2VTbPIvJ
Name 3,4,5-trimethoxybenzoic acid, ester with 2-chloro-10-{2-[4-(2-hydroxyethyl)-1-piperazinyl]propionyl}phenothiazine, dioxalate
Conditions Neutral
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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
Sadtler IR Number 31592
Sadtler UV Number 13553N
Solvent Methanol