| SpectraBase Compound ID | AeDYuXca9hO |
|---|---|
| InChI | InChI=1S/C6H18O24P6.12Na.O/c7-31(8,9)25-1-2(26-32(10,11)12)4(28-34(16,17)18)6(30-36(22,23)24)5(29-35(19,20)21)3(1)27-33(13,14)15;;;;;;;;;;;;;/h1-6H,(H2,7,8,9)(H2,10,11,12)(H2,13,14,15)(H2,16,17,18)(H2,19,20,21)(H2,22,23,24);;;;;;;;;;;;;/q;12*+1;/p-12 |
| InChIKey | JQFSHENNQZLVNF-UHFFFAOYSA-B |
| Mol Weight | 939.80880338 g/mol |
| Molecular Formula | C6H6Na12O25P6 |
| Exact Mass | 939.639619 g/mol |
Attenuated Total Reflectance Infrared (ATR-IR) Spectrum
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| SpectraBase Spectrum ID | EO92aBqrIba |
|---|---|
| Name | Phytic acid dodecasodium salt hydrate |
| Source of Sample | Aldrich |
| Catalog Number | 274321 |
| CAS Registry Number | 123408-98-0 |
| Comments | MW calculated on anhydrous base |
| Copyright | Copyright © 2018-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2018-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C6H18Na12O24P6*xH2O |
| InChI | InChI=1S/C6H18O24P6.12Na.O/c7-31(8,9)25-1-2(26-32(10,11)12)4(28-34(16,17)18)6(30-36(22,23)24)5(29-35(19,20)21)3(1)27-33(13,14)15;;;;;;;;;;;;;/h1-6H,(H2,7,8,9)(H2,10,11,12)(H2,13,14,15)(H2,16,17,18)(H2,19,20,21)(H2,22,23,24);;;;;;;;;;;;;/q;12*+1;/p-12 |
| InChIKey | JQFSHENNQZLVNF-UHFFFAOYSA-B |
| Synonyms | myo-inositol hexakis(dihydrogen phosphate) dodecasodium salt |
| Wiley ID | SIAL_ATR-IR_013508 |