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3a,5-Dimethyl[1,3]thiazolo[5,4-c]quinoline-2,4(3aH,5H)-dione

View entire compound with spectra: 1 FTIR, and 1 MS (GC)

3a,5-Dimethyl[1,3]thiazolo[5,4-c]quinoline-2,4(3aH,5H)-dione
SpectraBase Compound ID LhtCGAzfeag
InChI InChI=1S/C12H10N2O2S/c1-12-9(13-11(16)17-12)7-5-3-4-6-8(7)14(2)10(12)15/h3-6H,1-2H3
InChIKey ICGKOGAOUVTHRU-UHFFFAOYSA-N
Mol Weight 246.28 g/mol
Molecular Formula C12H10N2O2S
Exact Mass 246.046299 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 6Fc39vMsI2i
Name 3A,5-Dimethyl[1,3]thiazolo[5,4-C]quinoline-2,4(3ah,5H)-dione
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 246.046298742 u
Formula C12H10N2O2S
InChI InChI=1S/C12H10N2O2S/c1-12-9(13-11(16)17-12)7-5-3-4-6-8(7)14(2)10(12)15/h3-6H,1-2H3
InChIKey ICGKOGAOUVTHRU-UHFFFAOYSA-N
Molecular Weight 246.284 g/mol
SMILES C1(N(C=2C=CC=CC2C=2C1(SC(N2)=O)C)C)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.921253