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M-CRESOL PURPLE, SODIUM SALT(62625-31-4) IR1
Product NameM-CRESOL PURPLE, SODIUM SALT
CAS62625-31-4
Molecular FormulaC21H17NaO5S
Molecular Weight404.41
InChIInChI=1S/C21H18O5S.Na/c1-13-11-15(22)7-9-17(13)21(18-10-8-16(23)12-14(18)2)19-5-3-4-6-20(19)27(24,25)26;/h3-12,22H,1-2H3,(H,24,25,26);/q;+1/p-1/b21-18+;
InChIKey BYQJYOOKENJSNK-GOSREXKOSA-M
SmilesC(=C1/C=CC(=O)C=C/1C)(\C1C=CC(O)=CC=1C)/C1C=CC=CC=1S([O-])(=O)=O.[Na+]
