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2,9,16,23-Tetra-tert-butyl-29H,31H-phthalocyanine
SpectraBase Compound ID Cr3eObqrgen
InChI InChI=1S/C48H50N8/c1-45(2,3)25-13-17-29-33(21-25)41-49-37(29)54-42-35-23-27(47(7,8)9)15-19-31(35)39(51-42)56-44-36-24-28(48(10,11)12)16-20-32(36)40(52-44)55-43-34-22-26(46(4,5)6)14-18-30(34)38(50-43)53-41/h13-24H,1-12H3,(H2,49,50,51,52,53,54,55,56)
InChIKey NNQWYGKROBKYQC-UHFFFAOYSA-N
Mol Weight 739.0 g/mol
Molecular Formula C48H50N8
Exact Mass 738.415844 g/mol

Attenuated Total Reflectance Infrared (ATR-IR) Spectrum

Attenuated Total Reflectance Infrared (ATR-IR) Spectrum

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SpectraBase Spectrum ID KdzY5bk2MNo
Name 2,9,16,23-Tetra-tert-butyl-29H,31H-phthalocyanine
Source of Sample Aldrich
Catalog Number 423157
CAS Registry Number 35984-93-1
Copyright Copyright © 2018-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2018-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C48H50N8
InChI InChI=1S/C48H50N8/c1-45(2,3)25-13-17-29-33(21-25)41-49-37(29)54-42-35-23-27(47(7,8)9)15-19-31(35)39(51-42)56-44-36-24-28(48(10,11)12)16-20-32(36)40(52-44)55-43-34-22-26(46(4,5)6)14-18-30(34)38(50-43)53-41/h13-24H,1-12H3,(H2,49,50,51,52,53,54,55,56)
InChIKey NNQWYGKROBKYQC-UHFFFAOYSA-N
Purity Dye content 97%
Wiley ID SIAL_ATR-IR_019124