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1-Azacyclononane-1-thiocarboxylic acid 2-[1-[2-pyridyl]ethylidene]hydrazide
SpectraBase Compound ID CN7o2aR1RSt
InChI InChI=1S/C16H24N4S/c1-14(15-10-6-7-11-17-15)18-19-16(21)20-12-8-4-2-3-5-9-13-20/h6-7,10-11H,2-5,8-9,12-13H2,1H3,(H,19,21)/b18-14+
InChIKey RGTRFKVNYVUDGX-NBVRZTHBSA-N
Mol Weight 304.46 g/mol
Molecular Formula C16H24N4S
Exact Mass 304.172168 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID HltMXshVc13
Name 1-Azacyclononane-1-thiocarboxylic acid 2-[1-[2-pyridyl]ethylidene]hydrazide
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 304.172167963 u
Formula C16H24N4S
InChI InChI=1S/C16H24N4S/c1-14(15-10-6-7-11-17-15)18-19-16(21)20-12-8-4-2-3-5-9-13-20/h6-7,10-11H,2-5,8-9,12-13H2,1H3,(H,19,21)/b18-14+
InChIKey RGTRFKVNYVUDGX-NBVRZTHBSA-N
Molecular Weight 304.456 g/mol
SMILES C1CCCCCCN(C1)C(=S)N\N=C\(C1=CC=CC=N1)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.850344