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2-Propanone, 1-(2,2-dimethyl-4,6-dioxo-1,3-dioxan-5-ylidene)-, aldehydo-(phenylhydrazone)
SpectraBase Compound ID Fqxk1LnDEZ9
InChI InChI=1S/C15H16N2O4/c1-10(16-17-11-7-5-4-6-8-11)9-12-13(18)20-15(2,3)21-14(12)19/h4-9,17H,1-3H3/b16-10+
InChIKey QTPKSOODHMSANS-MHWRWJLKSA-N
Mol Weight 288.3 g/mol
Molecular Formula C15H16N2O4
Exact Mass 288.111007 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 9agj6quV4nW
Name 2-Propanone, 1-(2,2-dimethyl-4,6-dioxo-1,3-dioxan-5-ylidene)-, aldehydo-(phenylhydrazone)
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 288.111006999 u
Formula C15H16N2O4
InChI InChI=1S/C15H16N2O4/c1-10(16-17-11-7-5-4-6-8-11)9-12-13(18)20-15(2,3)21-14(12)19/h4-9,17H,1-3H3/b16-10+
InChIKey QTPKSOODHMSANS-MHWRWJLKSA-N
SMILES C1(C(OC(OC1=O)(C)C)=O)=C\C(=N\NC=1C=CC=CC1)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.968929