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Acrylothiamide, 3-morpholino-2-phenyl-N-(morpholinomethylene)-
SpectraBase Compound ID 5cWxY6Esatp
InChI InChI=1S/C18H23N3O2S/c24-18(19-15-21-8-12-23-13-9-21)17(16-4-2-1-3-5-16)14-20-6-10-22-11-7-20/h1-5,14-15H,6-13H2/b17-14+,19-15+
InChIKey QFUXBBDDGKNVHU-GVMPNVMCSA-N
Mol Weight 345.46 g/mol
Molecular Formula C18H23N3O2S
Exact Mass 345.151098 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 2dqyZGNhS2S
Name Acrylothiamide, 3-morpholino-2-phenyl-N-(morpholinomethylene)-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 345.151098165 u
Formula C18H23N3O2S
InChI InChI=1S/C18H23N3O2S/c24-18(19-15-21-8-12-23-13-9-21)17(16-4-2-1-3-5-16)14-20-6-10-22-11-7-20/h1-5,14-15H,6-13H2/b17-14+,19-15+
InChIKey QFUXBBDDGKNVHU-GVMPNVMCSA-N
Molecular Weight 345.461 g/mol
SMILES C1N(CCOC1)\C=C\(C(\N=C\N1CCOCC1)=S)C1=CC=CC=C1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.978244