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7-Benzoxyindane-1-carbaldehyde

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

7-Benzoxyindane-1-carbaldehyde
SpectraBase Compound ID EBPNkj4KiQQ
InChI InChI=1S/C17H16O2/c18-11-15-10-9-14-7-4-8-16(17(14)15)19-12-13-5-2-1-3-6-13/h1-8,11,15H,9-10,12H2
InChIKey ZPLJWGUPSATNCK-UHFFFAOYSA-N
Mol Weight 252.31 g/mol
Molecular Formula C17H16O2
Exact Mass 252.11503 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID AFUKK3DeZDc
Name 7-Benzoxyindane-1-carbaldehyde
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 252.115029753 u
Formula C17H16O2
InChI InChI=1S/C17H16O2/c18-11-15-10-9-14-7-4-8-16(17(14)15)19-12-13-5-2-1-3-6-13/h1-8,11,15H,9-10,12H2
InChIKey ZPLJWGUPSATNCK-UHFFFAOYSA-N
Molecular Weight 252.313 g/mol
SMILES C=12C(OCC=3C=CC=CC3)=CC=CC1CCC2C=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.915458