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Benzaldehyde, 3-bromo-5-methoxy-4-[(3-methylphenyl)methoxy]-
SpectraBase Compound ID DV8vrZxU4zJ
InChI InChI=1S/C16H15BrO3/c1-11-4-3-5-12(6-11)10-20-16-14(17)7-13(9-18)8-15(16)19-2/h3-9H,10H2,1-2H3
InChIKey MCRZEGYDSTZPBA-UHFFFAOYSA-N
Mol Weight 335.2 g/mol
Molecular Formula C16H15BrO3
Exact Mass 334.020457 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID FNS1t89lS9g
Name Benzaldehyde, 3-bromo-5-methoxy-4-[(3-methylphenyl)methoxy]-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 334.020457340 u
Formula C16H15BrO3
InChI InChI=1S/C16H15BrO3/c1-11-4-3-5-12(6-11)10-20-16-14(17)7-13(9-18)8-15(16)19-2/h3-9H,10H2,1-2H3
InChIKey MCRZEGYDSTZPBA-UHFFFAOYSA-N
Molecular Weight 335.197 g/mol
SMILES C1=CC=C(C=C1COC1=C(C=C(C=O)C=C1Br)OC)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.951534