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3,3,7,7-Tetramethyl-10-phenyl-3,4,5,6,7,10-hexahydro-1H,9H-bis(pyrano)[4,3-B:3',4'-E]pyridin-1,9-dione
SpectraBase Compound ID 1Xf3Puz7mRp
InChI InChI=1S/C21H23NO4/c1-20(2)10-13-16(18(23)25-20)15(12-8-6-5-7-9-12)17-14(22-13)11-21(3,4)26-19(17)24/h5-9,15,22H,10-11H2,1-4H3
InChIKey GEUXFDLDHRIUPC-UHFFFAOYSA-N
Mol Weight 353.42 g/mol
Molecular Formula C21H23NO4
Exact Mass 353.162708 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 2b5PrUVZQvc
Name 3,3,7,7-Tetramethyl-10-phenyl-3,4,5,6,7,10-hexahydro-1H,9H-bis(pyrano)[4,3-B:3',4'-E]pyridin-1,9-dione
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 353.162708221 u
Formula C21H23NO4
InChI InChI=1S/C21H23NO4/c1-20(2)10-13-16(18(23)25-20)15(12-8-6-5-7-9-12)17-14(22-13)11-21(3,4)26-19(17)24/h5-9,15,22H,10-11H2,1-4H3
InChIKey GEUXFDLDHRIUPC-UHFFFAOYSA-N
Molecular Weight 353.418 g/mol
SMILES C=12C(C=3C(OC(CC3NC1CC(OC2=O)(C)C)(C)C)=O)C1=CC=CC=C1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.975148