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Xylenol Orange sodium salt

View entire compound with spectra: 2 FTIR

Xylenol Orange sodium salt
SpectraBase Compound ID 6KvKT7hEXey
InChI InChI=1S/C31H32N2O13S.Na/c1-17-7-19(9-21(30(17)42)11-32(13-25(34)35)14-26(36)37)29(23-5-3-4-6-24(23)47(44,45)46)20-8-18(2)31(43)22(10-20)12-33(15-27(38)39)16-28(40)41;/h3-10,42H,11-16H2,1-2H3,(H,34,35)(H,36,37)(H,38,39)(H,40,41)(H,44,45,46);/q;+1/p-1
InChIKey VFKMJZUEFSTCGQ-UHFFFAOYSA-M
Mol Weight 694.64 g/mol
Molecular Formula C31H31N2NaO13S
Exact Mass 694.144455 g/mol

Attenuated Total Reflectance Infrared (ATR-IR) Spectrum

Attenuated Total Reflectance Infrared (ATR-IR) Spectrum

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SpectraBase Spectrum ID JCSnZh3Za0a
Name Xylenol Orange sodium salt
Source of Sample Alfa Aesar, A Johnson Matthey Company
Catalog Number B21414
Lot Number 10149679
CAS Registry Number 63721-83-5
Copyright Copyright © 2015-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C31H31N2NaO13S
InChI InChI=1S/C31H32N2O13S.Na/c1-17-7-19(9-21(30(17)42)11-32(13-25(34)35)14-26(36)37)29(23-5-3-4-6-24(23)47(44,45)46)20-8-18(2)31(43)22(10-20)12-33(15-27(38)39)16-28(40)41;/h3-10,42H,11-16H2,1-2H3,(H,34,35)(H,36,37)(H,38,39)(H,40,41)(H,44,45,46);/q;+1/p-1
InChIKey VFKMJZUEFSTCGQ-UHFFFAOYSA-M
Instrument Name Bruker Tensor 27 FT-IR
Physical State Solid
Sample Type Organic
Source of Spectrum Bio-Rad Laboratories, Inc.
Synonyms 3,3′-Bis[N,N-bis(carboxymethyl)aminomethyl]-o-cresolsulfonephthalein tetrasodium salt
Technique ATR-Neat (DuraSamplIR II)