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5-(Diphenylmethyl)-6-methylthiazolo[3,2-a]pyrimidin-7-one
SpectraBase Compound ID 2OpEc8d06Zi
InChI InChI=1S/C20H16N2OS/c1-14-18(22-12-13-24-20(22)21-19(14)23)17(15-8-4-2-5-9-15)16-10-6-3-7-11-16/h2-13,17H,1H3
InChIKey LTIGDWGNZKBBTJ-UHFFFAOYSA-N
Mol Weight 332.42 g/mol
Molecular Formula C20H16N2OS
Exact Mass 332.098334 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 1CDgK0vGwsO
Name 5-(Diphenylmethyl)-6-methylthiazolo[3,2-A]pyrimidin-7-one
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 332.098334316 u
Formula C20H16N2OS
InChI InChI=1S/C20H16N2OS/c1-14-18(22-12-13-24-20(22)21-19(14)23)17(15-8-4-2-5-9-15)16-10-6-3-7-11-16/h2-13,17H,1H3
InChIKey LTIGDWGNZKBBTJ-UHFFFAOYSA-N
Molecular Weight 332.421 g/mol
SMILES C12=NC(C(=C(N2C=CS1)C(C1=CC=CC=C1)C=1C=CC=CC1)C)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.910015