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 |
SpectraBase Spectrum ID | 7sWmx08gdgK |
---|---|
Name | Xylenol Orange sodium salt |
Source of Sample | Alfa Aesar |
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 |
KBr Capsule ID | K-01724 |
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 | KBr1 |