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acetic acid, [(1-cyclohexyl-1H-tetrazol-5-yl)thio]-
SpectraBase Compound ID 4OgolReDggu
InChI InChI=1S/C9H14N4O2S/c14-8(15)6-16-9-10-11-12-13(9)7-4-2-1-3-5-7/h7H,1-6H2,(H,14,15)
InChIKey SNLAUQZZWULDIQ-UHFFFAOYSA-N
Mol Weight 242.3 g/mol
Molecular Formula C9H14N4O2S
Exact Mass 242.083747 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4oTIF56TnbU
Name Acetic acid, [(1-cyclohexyl-1H-tetrazol-5-yl)thio]-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 242.083746879 u
Formula C9H14N4O2S
InChI InChI=1S/C9H14N4O2S/c14-8(15)6-16-9-10-11-12-13(9)7-4-2-1-3-5-7/h7H,1-6H2,(H,14,15)
InChIKey SNLAUQZZWULDIQ-UHFFFAOYSA-N
Molecular Weight 242.297 g/mol
SMILES OC(CSC=1N(N=NN1)C1CCCCC1)=O