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3'-(methylthio)-2,4,6-trinitrodiphenylamine

View entire compound with spectra: 2 NMR, and 1 FTIR

3'-(methylthio)-2,4,6-trinitrodiphenylamine
SpectraBase Compound ID DxFkjUKIacz
InChI InChI=1S/C13H10N4O6S/c1-24-10-4-2-3-8(5-10)14-13-11(16(20)21)6-9(15(18)19)7-12(13)17(22)23/h2-7,14H,1H3
InChIKey ZITLQFIBZHKQNE-UHFFFAOYSA-N
Mol Weight 350.31 g/mol
Molecular Formula C13H10N4O6S
Exact Mass 350.032105 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID ITWTb9a0dJI
Name 3'-(METHYLTHIO)-2,4,6-TRINITRODIPHENYLAMINE
Source of Sample Aldrich Chemical Company, Inc., Milwaukee, Wisconsin
Catalog Number S59391
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H10N4O6S
InChI InChI=1S/C13H10N4O6S/c1-24-10-4-2-3-8(5-10)14-13-11(16(20)21)6-9(15(18)19)7-12(13)17(22)23/h2-7,14H,1H3
InChIKey ZITLQFIBZHKQNE-UHFFFAOYSA-N
Molecular Weight 350.304993
Synonyms DIPHENYLAMINE, 3*-/METHYLTHIO/- 2,4,6-TRINITRO-,
Technique KBr WAFER