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Bis[4-phenylthiadiazolone]

View entire compound with spectra: 1 NMR, 1 FTIR, and 1 MS (GC)

Bis[4-phenylthiadiazolone]
SpectraBase Compound ID IzjXLvTFpQL
InChI InChI=1S/C16H10N4O2S2/c21-15-19(11-7-3-1-4-8-11)17-13(23-15)14-18-20(16(22)24-14)12-9-5-2-6-10-12/h1-10H
InChIKey ZBZFSWSNPFNHMC-UHFFFAOYSA-N
Mol Weight 354.4 g/mol
Molecular Formula C16H10N4O2S2
Exact Mass 354.024518 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID FEtQVQvi6U4
Name bis[4-Phenylthiadiazolone]
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 354.024517924 u
Formula C16H10N4O2S2
InChI InChI=1S/C16H10N4O2S2/c21-15-19(11-7-3-1-4-8-11)17-13(23-15)14-18-20(16(22)24-14)12-9-5-2-6-10-12/h1-10H
InChIKey ZBZFSWSNPFNHMC-UHFFFAOYSA-N
Molecular Weight 354.402 g/mol
SMILES C1(C2=NN(C3=CC=CC=C3)C(S2)=O)=NN(C2=CC=CC=C2)C(S1)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.926456