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2H-pyran-2,4(3H)-dione, dihydro-3,3,5,5-tetramethyl-6-(4-nitrophenyl)-

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

2H-pyran-2,4(3H)-dione, dihydro-3,3,5,5-tetramethyl-6-(4-nitrophenyl)-
SpectraBase Compound ID 3Dcinxbiugv
InChI InChI=1S/C15H17NO5/c1-14(2)11(21-13(18)15(3,4)12(14)17)9-5-7-10(8-6-9)16(19)20/h5-8,11H,1-4H3
InChIKey ZRDYCSSILVXCHI-UHFFFAOYSA-N
Mol Weight 291.3 g/mol
Molecular Formula C15H17NO5
Exact Mass 291.110673 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 3ViE24fLJLZ
Name 2H-Pyran-2,4(3H)-dione, dihydro-3,3,5,5-tetramethyl-6-(4-nitrophenyl)-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 291.110672646 u
Formula C15H17NO5
InChI InChI=1S/C15H17NO5/c1-14(2)11(21-13(18)15(3,4)12(14)17)9-5-7-10(8-6-9)16(19)20/h5-8,11H,1-4H3
InChIKey ZRDYCSSILVXCHI-UHFFFAOYSA-N
SMILES C1(C(C(C)(C)C(OC1=O)C=1C=CC(N(=O)=O)=CC1)=O)(C)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.850531