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4-Benzyl-2,3-dihydrothieno[3,2-b]quinolin-9-one 1,1-dioxide
SpectraBase Compound ID A4FEekjIxzA
InChI InChI=1S/C18H15NO3S/c20-17-14-8-4-5-9-15(14)19(12-13-6-2-1-3-7-13)16-10-11-23(21,22)18(16)17/h1-9H,10-12H2
InChIKey SSTIQQCUVPLKMF-UHFFFAOYSA-N
Mol Weight 325.38 g/mol
Molecular Formula C18H15NO3S
Exact Mass 325.077265 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 3QcyUhky7ss
Name 4-Benzyl-2,3-dihydrothieno[3,2-B]quinolin-9-one 1,1-dioxide
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 325.077264518 u
Formula C18H15NO3S
InChI InChI=1S/C18H15NO3S/c20-17-14-8-4-5-9-15(14)19(12-13-6-2-1-3-7-13)16-10-11-23(21,22)18(16)17/h1-9H,10-12H2
InChIKey SSTIQQCUVPLKMF-UHFFFAOYSA-N
Molecular Weight 325.382 g/mol
SMILES C12=C(N(CC=3C=CC=CC3)C3=C(C1=O)C=CC=C3)CCS2(=O)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.803686