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Dispiro[indan-1,7'-norcara-2',4'-diene-3,7''-norcara-2'',4''-dien]-2-one
SpectraBase Compound ID 5IvpCX40plq
InChI InChI=1S/C21H16O/c22-19-20(13-7-1-2-8-14(13)20)17-11-5-6-12-18(17)21(19)15-9-3-4-10-16(15)21/h1-16H
InChIKey OIPHFNPPIVYVMZ-UHFFFAOYSA-N
Mol Weight 284.36 g/mol
Molecular Formula C21H16O
Exact Mass 284.120115 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID HGVHhXZhGf
Name Dispiro[indan-1,7'-norcara-2',4'-diene-3,7''-norcara-2'',4''-dien]-2-one
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 284.120115134 u
Formula C21H16O
InChI InChI=1S/C21H16O/c22-19-20(13-7-1-2-8-14(13)20)17-11-5-6-12-18(17)21(19)15-9-3-4-10-16(15)21/h1-16H
InChIKey OIPHFNPPIVYVMZ-UHFFFAOYSA-N
SMILES C12(C(C3(C4C=CC=CC34)C=3C2=CC=CC3)=O)C2C=CC=CC12
Spectrum/Structure Validation Score (Vapor Phase IR) 0.942972