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3-amino-1-[2-amino-4-(methylsulfonyl)phenyl]-2-pyrazolin-5-one

View entire compound with spectra: 1 NMR, and 1 FTIR

3-amino-1-[2-amino-4-(methylsulfonyl)phenyl]-2-pyrazolin-5-one
SpectraBase Compound ID 94kTPIBk9v9
InChI InChI=1S/C10H12N4O3S/c1-18(16,17)6-2-3-8(7(11)4-6)14-10(15)5-9(12)13-14/h2-4H,5,11H2,1H3,(H2,12,13)
InChIKey XQSOBSQSXCCMRH-UHFFFAOYSA-N
Mol Weight 268.29 g/mol
Molecular Formula C10H12N4O3S
Exact Mass 268.063011 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID FNM3jhAjjdt
Name 3-AMINO-1-[2-AMINO-4-(METHYLSULFONYL)PHENYL]-2-PYRAZOLIN-5-ONE
Source of Sample Aldrich Chemical Company, Inc., Milwaukee, Wisconsin
Catalog Number S64225
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H12N4O3S
InChI InChI=1S/C10H12N4O3S/c1-18(16,17)6-2-3-8(7(11)4-6)14-10(15)5-9(12)13-14/h2-4H,5,11H2,1H3,(H2,12,13)
InChIKey XQSOBSQSXCCMRH-UHFFFAOYSA-N
Molecular Weight 268.290985
Synonyms 2-PYRAZOLIN-5-ONE, 3-AMINO- 1-/2-AMINO-4-/METHYLSULFONYL/PHENYL/-,
Technique KBr WAFER