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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 9h9QXoLxkKE
Name 5,5'-Dithiobis-(2-nitrobenzoic acid)
Alternate Name(s) 2,2'-Dinitro-5,5'-dithiodibenzoesaeure 2,2'-Dinitro-5,5'-dithiodibenzoic acid 3,3'-Dithiobis(6-nitrobenzoic acid) 5-[(3-carboxy-4-nitro-phenyl)disulfanyl]-2-nitro-benzoic acid Benzoic acid, 3,3'-dithiobis[6-nitro-
CAS Registry Number 69-78-3
Copyright Copyright © 2020-2024 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
Molecular Weight 396.344 g/mol
SMILES OC(c1c(ccc(SSc2cc(C(=O)O)c(cc2)N(=O)=O)c1)N(=O)=O)=O
SPLASH splash10-0002-7709000000-2cce1187ca7ec7adfe32
Wiley ID 1472453