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(Z)-Methyl 2-((Z)-3-benzyl-2-{(E)-[(E)-hex-2-enylidene]-hydrazono}-4-oxothiazolidin-5-ylidene)acetate
SpectraBase Compound ID 9TkiRL6vSm8
InChI InChI=1S/C19H21N3O3S/c1-3-4-5-9-12-20-21-19-22(14-15-10-7-6-8-11-15)18(24)16(26-19)13-17(23)25-2/h5-13H,3-4,14H2,1-2H3/b9-5+,16-13-,20-12+,21-19-
InChIKey UBTOAMRFZNMPOW-ODIPFQJBSA-N
Mol Weight 371.46 g/mol
Molecular Formula C19H21N3O3S
Exact Mass 371.130363 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID EJIM0iHvyLv
Name (Z)-Methyl 2-((Z)-3-benzyl-2-{(E)-[(E)-hex-2-enylidene]-hydrazono}-4-oxothiazolidin-5-ylidene)acetate
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 371.130362719 u
Formula C19H21N3O3S
InChI InChI=1S/C19H21N3O3S/c1-3-4-5-9-12-20-21-19-22(14-15-10-7-6-8-11-15)18(24)16(26-19)13-17(23)25-2/h5-13H,3-4,14H2,1-2H3/b9-5+,16-13-,20-12+,21-19-
InChIKey UBTOAMRFZNMPOW-ODIPFQJBSA-N
Molecular Weight 371.455 g/mol
SMILES C1(\C(S\C(N1CC1=CC=CC=C1)=N\N=C\C=C\CCC)=C\C(=O)OC)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.908624