Thymolphthalein monophosphoric acid, disodium salt hydrate

SpectraBase Compound ID	Jp7YoGk8rf0
InChI	InChI=1S/C28H31O7P.2Na.H2O/c1-15(2)20-13-23(17(5)11-25(20)29)28(22-10-8-7-9-19(22)27(30)34-28)24-14-21(16(3)4)26(12-18(24)6)35-36(31,32)33;;;/h7-16,29H,1-6H3,(H2,31,32,33);;;1H2/q;2*+1;/p-2
InChIKey	VXAAAGIFNPRCKZ-UHFFFAOYSA-L Google Search
Mol Weight	572.50130056 g/mol
Molecular Formula	C28H31Na2O8P
Exact Mass	572.155194 g/mol

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SpectraBase Spectrum ID	4t6cuoll1gc
Name	Thymolphthalein monophosphoric acid, disodium salt hydrate
Source of Sample	Sigma-Aldrich
Catalog Number	201367
CAS Registry Number	123359-43-3
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	C28H29O7P2NaxH2O
InChI	InChI=1S/C28H31O7P.2Na.H2O/c1-15(2)20-13-23(17(5)11-25(20)29)28(22-10-8-7-9-19(22)27(30)34-28)24-14-21(16(3)4)26(12-18(24)6)35-36(31,32)33;;;/h7-16,29H,1-6H3,(H2,31,32,33);;;1H2/q;2*+1;/p-2
InChIKey	VXAAAGIFNPRCKZ-UHFFFAOYSA-L
Wiley ID	SIAL_ATR-IR_010327