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Bromocresol green

View entire compound with spectra: 1 NMR, 7 FTIR, and 1 MS (GC)

Bromocresol green
SpectraBase Compound ID HNppLNB5eme
InChI InChI=1S/C21H14Br4O5S/c1-9-12(7-14(22)19(26)17(9)24)21(13-8-15(23)20(27)18(25)10(13)2)11-5-3-4-6-16(11)31(28,29)30-21/h3-8,26-27H,1-2H3
InChIKey FRPHFZCDPYBUAU-UHFFFAOYSA-N
Mol Weight 698.01 g/mol
Molecular Formula C21H14Br4O5S
Exact Mass 693.729547 g/mol

Attenuated Total Reflectance Infrared (ATR-IR) Spectrum

Attenuated Total Reflectance Infrared (ATR-IR) Spectrum

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SpectraBase Spectrum ID H00KmibYH2n
Name Bromocresol Green Sultone Form
Source of Sample Sigma-Aldrich
Catalog Number B0381
CAS Registry Number 76-60-8
Copyright Copyright © 2018-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2018-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H14Br4O5S
InChI InChI=1S/C21H14Br4O5S/c1-9-12(7-14(22)19(26)17(9)24)21(13-8-15(23)20(27)18(25)10(13)2)11-5-3-4-6-16(11)31(28,29)30-21/h3-8,26-27H,1-2H3
InChIKey FRPHFZCDPYBUAU-UHFFFAOYSA-N
Purity powder
Synonyms 3',3'',5',5''-Tetrabromo-m-cresolsulfonephthalein; Bromocresol Blue
Wiley ID SIAL_ATR-IR_039318