| SpectraBase Compound ID | 681K8Z5nXY6 |
|---|---|
| InChI | InChI=1S/C38H44N2O12.2Na/c1-19(2)24-11-29(21(5)26(35(24)49)13-39(15-31(41)42)16-32(43)44)38(28-10-8-7-9-23(28)37(51)52-38)30-12-25(20(3)4)36(50)27(22(30)6)14-40(17-33(45)46)18-34(47)48;;/h7-12,19-20,49-50H,13-18H2,1-6H3,(H,41,42)(H,43,44)(H,45,46)(H,47,48);;/q;2*+1 |
| InChIKey | UCLAJMNWLHZANO-UHFFFAOYSA-N |
| Mol Weight | 766.75153856 g/mol |
| Molecular Formula | C38H44N2Na2O12 |
| Exact Mass | 766.268963 g/mol |
Attenuated Total Reflectance Infrared (ATR-IR) Spectrum
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| SpectraBase Spectrum ID | JKevO3eNCFO |
|---|---|
| Name | Thymolphthalein Complexone sodium salt |
| Source of Sample | Sigma-Aldrich |
| Catalog Number | 513849 |
| CAS Registry Number | 85409-48-9 |
| Copyright | Copyright © 2018-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2018-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C38H44N2Na2O12 |
| InChI | InChI=1S/C38H44N2O12.2Na/c1-19(2)24-11-29(21(5)26(35(24)49)13-39(15-31(41)42)16-32(43)44)38(28-10-8-7-9-23(28)37(51)52-38)30-12-25(20(3)4)36(50)27(22(30)6)14-40(17-33(45)46)18-34(47)48;;/h7-12,19-20,49-50H,13-18H2,1-6H3,(H,41,42)(H,43,44)(H,45,46)(H,47,48);;/q;2*+1 |
| InChIKey | UCLAJMNWLHZANO-UHFFFAOYSA-N |
| Wiley ID | SIAL_ATR-IR_020503 |