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o-Cresolphthalein complexone tetrasodium salt

View entire compound with spectra: 2 FTIR, and 1 Raman

o-Cresolphthalein complexone tetrasodium salt
SpectraBase Compound ID 2NCyDfOj0Nl
InChI InChI=1S/C32H32N2O12.4Na/c1-17-7-21(9-19(29(17)43)11-33(13-25(35)36)14-26(37)38)32(24-6-4-3-5-23(24)31(45)46-32)22-8-18(2)30(44)20(10-22)12-34(15-27(39)40)16-28(41)42;;;;/h3-10,43-44H,11-16H2,1-2H3,(H,35,36)(H,37,38)(H,39,40)(H,41,42);;;;/q;4*+1/p-4
InChIKey KSMPPVYJZJBIES-UHFFFAOYSA-J
Mol Weight 724.53707713 g/mol
Molecular Formula C32H28N2Na4O12
Exact Mass 724.123301 g/mol

Attenuated Total Reflectance Infrared (ATR-IR) Spectrum

Attenuated Total Reflectance Infrared (ATR-IR) Spectrum

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SpectraBase Spectrum ID 4hR1upXVArM
Name o-Cresolphthalein complexone tetrasodium salt
Source of Sample Alfa Aesar, A Johnson Matthey Company
Catalog Number A17941
Lot Number G4567A
CAS Registry Number 62698-54-8
Copyright Copyright © 2015-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C32H28N2Na4O12
InChI InChI=1S/C32H32N2O12.4Na/c1-17-7-21(9-19(29(17)43)11-33(13-25(35)36)14-26(37)38)32(24-6-4-3-5-23(24)31(45)46-32)22-8-18(2)30(44)20(10-22)12-34(15-27(39)40)16-28(41)42;;;;/h3-10,43-44H,11-16H2,1-2H3,(H,35,36)(H,37,38)(H,39,40)(H,41,42);;;;/q;4*+1/p-4
InChIKey KSMPPVYJZJBIES-UHFFFAOYSA-J
Instrument Name Bruker Tensor 27 FT-IR
Physical State Solid
Sample Type Organic
Source of Spectrum Bio-Rad Laboratories, Inc.
Synonyms o-Cresolphthalexon; Phthalein complexone sodium salt
Technique ATR-Neat (DuraSamplIR II)