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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

Raman Spectrum

Raman Spectrum

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SpectraBase Spectrum ID 9kd1c7OnryG
Name 5,5'-Dithiobis(2-nitrobenzoic acid)
Source of Sample Sigma-Aldrich Company LLC
Catalog Number D8130
Lot Number 10K3676
CAS Registry Number 69-78-3
Cell Type NMR tube
Compound Type Pure
Copyright Copyright © 2015-2024 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
Raman Corrections Referenced to internal white light source; 180 degree backscatter
Raman Laser Power 550 mW
Raman Laser Source Nd:YAG
SMILES OC(c1c(ccc(SSc2cc(c(cc2)N(=O)=O)C(O)=O)c1)N(=O)=O)=O
Scans Performed 5312
Source of Spectrum Forensic Spectral Research
Technique FT-Raman