![3,4,5-trimethoxybenzoic acid, ester with 2-chloro-10-{[4-(2-hydroxyethyl)-1-piperazinyl]acetyl}phenothiazine, diethanesulfonate](/api/spectrum/28snZxtvcRi/structure.png?h=300&w=458 "3,4,5-trimethoxybenzoic acid, ester with 2-chloro-10-{[4-(2-hydroxyethyl)-1-piperazinyl]acetyl}phenothiazine, diethanesulfonate")
| SpectraBase Compound ID | 41qrglXo5lu |
|---|---|
| InChI | InChI=1S/C30H32ClN3O6S.2C2H6O3S/c1-37-24-16-20(17-25(38-2)29(24)39-3)30(36)40-15-14-32-10-12-33(13-11-32)19-28(35)34-22-6-4-5-7-26(22)41-27-9-8-21(31)18-23(27)34;2*1-2-6(3,4)5/h4-9,16-18H,10-15,19H2,1-3H3;2*2H2,1H3,(H,3,4,5) |
| InChIKey | FDQYBMAVPLAMHX-UHFFFAOYSA-N |
| Mol Weight | 818.37 g/mol |
| Molecular Formula | C34H44ClN3O12S3 |
| Exact Mass | 817.177565 g/mol |
Ultraviolet-Visible (UV-Vis) Spectrum
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| SpectraBase Spectrum ID | 28snZxtvcRi |
|---|---|
| Name | 3,4,5-trimethoxybenzoic acid, ester with 2-chloro-10-{[4-(2-hydroxyethyl)-1-piperazinyl]acetyl}phenothiazine, diethanesulfonate |
| Conditions | Neutral |
| Copyright | Copyright © 2008-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C34H44ClN3O12S3 |
| InChI | InChI=1S/C30H32ClN3O6S.2C2H6O3S/c1-37-24-16-20(17-25(38-2)29(24)39-3)30(36)40-15-14-32-10-12-33(13-11-32)19-28(35)34-22-6-4-5-7-26(22)41-27-9-8-21(31)18-23(27)34;2*1-2-6(3,4)5/h4-9,16-18H,10-15,19H2,1-3H3;2*2H2,1H3,(H,3,4,5) |
| InChIKey | FDQYBMAVPLAMHX-UHFFFAOYSA-N |
| Sadtler IR Number | 31586 |
| Sadtler UV Number | 13548N |
| Solvent | Methanol |