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Butan-2-one, 4-(4-hydroxyphenyl)-, thiosemicarbazone
SpectraBase Compound ID IC9RDla2Hhq
InChI InChI=1S/C11H15N3OS/c1-8(13-14-11(12)16)2-3-9-4-6-10(15)7-5-9/h4-7,15H,2-3H2,1H3,(H3,12,14,16)/b13-8-
InChIKey MOEKCSYKLBVRDB-JYRVWZFOSA-N
Mol Weight 237.32 g/mol
Molecular Formula C11H15N3OS
Exact Mass 237.093583 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID DPY3gon3DMz
Name Butan-2-one, 4-(4-hydroxyphenyl)-, thiosemicarbazone
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 237.093583288 u
Formula C11H15N3OS
InChI InChI=1S/C11H15N3OS/c1-8(13-14-11(12)16)2-3-9-4-6-10(15)7-5-9/h4-7,15H,2-3H2,1H3,(H3,12,14,16)/b13-8-
InChIKey MOEKCSYKLBVRDB-JYRVWZFOSA-N
Molecular Weight 237.321 g/mol
SMILES C(N\N=C\(C)CCC=1C=CC(O)=CC1)(=S)N
Spectrum/Structure Validation Score (Vapor Phase IR) 0.925557