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1H-Indene-1,3(2H)-dione, 2-(tricyclo[8.2.2.24,7]hexadeca-4,6,10,12,13,15-hexaen-5-ylmethylene)-
SpectraBase Compound ID DLMEeweRSze
InChI InChI=1S/C26H20O2/c27-25-22-3-1-2-4-23(22)26(28)24(25)16-21-15-19-10-9-17-5-7-18(8-6-17)11-13-20(21)14-12-19/h1-8,12,14-16H,9-11,13H2
InChIKey JTKODGGENIEDNO-UHFFFAOYSA-N
Mol Weight 364.44 g/mol
Molecular Formula C26H20O2
Exact Mass 364.14633 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID D8dzfZ2OXfq
Name 1H-Indene-1,3(2H)-dione, 2-(tricyclo[8.2.2.24,7]hexadeca-4,6,10,12,13,15-hexaen-5-ylmethylene)-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 364.146329882 u
Formula C26H20O2
InChI InChI=1S/C26H20O2/c27-25-22-3-1-2-4-23(22)26(28)24(25)16-21-15-19-10-9-17-5-7-18(8-6-17)11-13-20(21)14-12-19/h1-8,12,14-16H,9-11,13H2
InChIKey JTKODGGENIEDNO-UHFFFAOYSA-N
Molecular Weight 364.444 g/mol
SMILES C1(C(C=2C=CC=CC2C1=O)=O)=CC1=C2CCC3=CC=C(CCC(=C1)C=C2)C=C3
Spectrum/Structure Validation Score (Vapor Phase IR) 0.912833