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5,5'-Dithiobis(2-nitrobenzoic acid)

View entire compound with spectra: 4 NMR, 7 FTIR, 4 Raman, and 2 MS (GC)

5,5'-Dithiobis(2-nitrobenzoic acid)
SpectraBase Compound ID 22k7Zb4e8OF
InChI InChI=1S/C14H8N2O8S2/c17-13(18)9-5-7(1-3-11(9)15(21)22)25-26-8-2-4-12(16(23)24)10(6-8)14(19)20/h1-6H,(H,17,18)(H,19,20)
InChIKey KIUMMUBSPKGMOY-UHFFFAOYSA-N
Mol Weight 396.34 g/mol
Molecular Formula C14H8N2O8S2
Exact Mass 395.972208 g/mol

Attenuated Total Reflectance Infrared (ATR-IR) Spectrum

Attenuated Total Reflectance Infrared (ATR-IR) Spectrum

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SpectraBase Spectrum ID 10qScRFo0fZ
Name 5,5'-Dithiobis(2-nitrobenzoic acid)
Source of Sample Calbiochem, EMD Chemicals, Inc., an Affiliate of Merck KGaA, Darmstadt, Germany
Catalog Number 322123
Lot Number 322123
Accessory DurasamplIR II
CAS Registry Number 69-78-3
Compound Type Pure
Copyright Copyright © 2012-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H8N2O8S2
InChI InChI=1S/C14H8N2O8S2/c17-13(18)9-5-7(1-3-11(9)15(21)22)25-26-8-2-4-12(16(23)24)10(6-8)14(19)20/h1-6H,(H,17,18)(H,19,20)
InChIKey KIUMMUBSPKGMOY-UHFFFAOYSA-N
Instrument Name Bio-Rad FTS
Source of Spectrum Forensic Spectral Research
Synonyms Bis(3-carboxy-4-nitrophenyl) disulfide; 3-Carboxy-4-nitrophenyl disulfide
Technique ATR-Neat (DuraSamplIR II)