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9-Hydroxy-9-methyl-3-xanthenecarboxaldehyde

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

9-Hydroxy-9-methyl-3-xanthenecarboxaldehyde
SpectraBase Compound ID CdXCAiczGw7
InChI InChI=1S/C15H12O3/c1-15(17)11-4-2-3-5-13(11)18-14-8-10(9-16)6-7-12(14)15/h2-9,17H,1H3
InChIKey WQDAJONAYUNFNM-UHFFFAOYSA-N
Mol Weight 240.26 g/mol
Molecular Formula C15H12O3
Exact Mass 240.078644 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 6AuY2KU95fh
Name 9-Hydroxy-9-methyl-3-xanthenecarboxaldehyde
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 240.078644243 u
Formula C15H12O3
InChI InChI=1S/C15H12O3/c1-15(17)11-4-2-3-5-13(11)18-14-8-10(9-16)6-7-12(14)15/h2-9,17H,1H3
InChIKey WQDAJONAYUNFNM-UHFFFAOYSA-N
Molecular Weight 240.258 g/mol
SMILES C1(C2=C(C=C(C=C2)C=O)OC2=C1C=CC=C2)(O)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.962819