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Naphthalene-1-carboxaldehyde, 4-methoxy-, thiosemicarbazone

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

Naphthalene-1-carboxaldehyde, 4-methoxy-, thiosemicarbazone
SpectraBase Compound ID G5Btl73LM41
InChI InChI=1S/C13H13N3OS/c1-17-12-7-6-9(8-15-16-13(14)18)10-4-2-3-5-11(10)12/h2-8H,1H3,(H3,14,16,18)/b15-8+
InChIKey QAYVZBRXUBLTQQ-OVCLIPMQSA-N
Mol Weight 259.33 g/mol
Molecular Formula C13H13N3OS
Exact Mass 259.077933 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID F97Yux2kgGD
Name Naphthalene-1-carboxaldehyde, 4-methoxy-, thiosemicarbazone
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 259.077933224 u
Formula C13H13N3OS
InChI InChI=1S/C13H13N3OS/c1-17-12-7-6-9(8-15-16-13(14)18)10-4-2-3-5-11(10)12/h2-8H,1H3,(H3,14,16,18)/b15-8+
InChIKey QAYVZBRXUBLTQQ-OVCLIPMQSA-N
SMILES C1=2C(=C(C=CC2\C=N\NC(N)=S)OC)C=CC=C1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.91094