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2-amino-5-(heptylthio)-1,3,4-thiadiazole

View entire compound with spectra: 2 NMR, 1 FTIR, 2 UV-Vis, and 1 MS (GC)

2-amino-5-(heptylthio)-1,3,4-thiadiazole
SpectraBase Compound ID IytweyiSjEt
InChI InChI=1S/C9H17N3S2/c1-2-3-4-5-6-7-13-9-12-11-8(10)14-9/h2-7H2,1H3,(H2,10,11)
InChIKey VXNPKYLZLLWUDZ-UHFFFAOYSA-N
Mol Weight 231.38 g/mol
Molecular Formula C9H17N3S2
Exact Mass 231.08639 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID LIGohBqmCiJ
Name 2-AMINO-5-(HEPTYLTHIO)-1,3,4-THIADIAZOLE
Source of Sample Maybridge Chemical Company Ltd., North Cornwall, England
Comments Tentative assignment
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H17N3S2
InChI InChI=1S/C9H17N3S2/c1-2-3-4-5-6-7-13-9-12-11-8(10)14-9/h2-7H2,1H3,(H2,10,11)
InChIKey VXNPKYLZLLWUDZ-UHFFFAOYSA-N
Melting Point 112C
Molecular Weight 231.38
Solvent Polysol; Reference=TMS Spectrometer= Varian CFT-20
Synonyms THIADIAZOLE, 1,3,4-, 2-AMINO- 5-/HEPTYLTHIO/-,