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1-Amino-2,5-dichlorobenzol-4-sulfonic acid->3-methyl-1-phenyl-5-aminopyrazol
SpectraBase Compound ID Es72jp8ICCy
InChI InChI=1S/C16H13Cl2N5O3S.Na/c1-9-15(16(19)23(22-9)10-5-3-2-4-6-10)21-20-13-7-12(18)14(8-11(13)17)27(24,25)26;/h2-8H,19H2,1H3,(H,24,25,26);/q;+1/p-1/b21-20+;
InChIKey OBXIFFBDSGAAGZ-ANVLNOONSA-M
Mol Weight 448.25976928 g/mol
Molecular Formula C16H12Cl2N5NaO3S
Exact Mass 446.99356 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID JZ1l3iRTkHT
Name 1-Amino-2,5-dichlorobenzol-4-sulfonic acid->3-methyl-1-phenyl-5-aminopyrazol
CAS Registry Number 55772-67-3
Copyright Copyright © 1989, 1990-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C16H12Cl2N5NaO3S
InChI InChI=1S/C16H13Cl2N5O3S.Na/c1-9-15(16(19)23(22-9)10-5-3-2-4-6-10)21-20-13-7-12(18)14(8-11(13)17)27(24,25)26;/h2-8H,19H2,1H3,(H,24,25,26);/q;+1/p-1/b21-20+;
InChIKey OBXIFFBDSGAAGZ-ANVLNOONSA-M
Instrument Name Bruker IFS 85
Technique KBr-Pellet