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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

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JHG4i5qDovo
Name 2,2'-DINITRO-5,5'-DITHIODIBENZOIC ACID
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. 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
Molecular Weight 395.9720
SMILES OC(c1cc(SSc2ccc(c(C(O)=O)c2)N(=O)=O)ccc1N(=O)=O)=O
SPLASH splash10-0002-8819000000-c4fdcb855225965afbe9
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