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2-Hydroxy-3-methoxy-4,5-methylenedioxybenzaldehyde

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

2-Hydroxy-3-methoxy-4,5-methylenedioxybenzaldehyde
SpectraBase Compound ID T6HCd11y4h
InChI InChI=1S/C9H8O5/c1-12-9-7(11)5(3-10)2-6-8(9)14-4-13-6/h2-3,11H,4H2,1H3
InChIKey UHSRARNFXZJEFW-UHFFFAOYSA-N
Mol Weight 196.16 g/mol
Molecular Formula C9H8O5
Exact Mass 196.037173 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 49wOdt7cG5e
Name 2-Hydroxy-3-methoxy-4,5-methylenedioxybenzaldehyde
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 196.037173353 u
Formula C9H8O5
InChI InChI=1S/C9H8O5/c1-12-9-7(11)5(3-10)2-6-8(9)14-4-13-6/h2-3,11H,4H2,1H3
InChIKey UHSRARNFXZJEFW-UHFFFAOYSA-N
Molecular Weight 196.158 g/mol
SMILES C(C=1C(=C(C2=C(C1)OCO2)OC)O)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.858877