3-Methoxybenzaldehyde

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Systematic / IUPAC Name: 3-Methoxybenzaldehyde

ID: Reference6560

Other Names: m-Anisaldehyde;
m-Methoxybenzaldehyde;
Benzaldehyde, 3-methoxy-

Formula: C8H8O2

Class: Endogenous Metabolites Excipients/Additives/Colorants

Spectral Data

3-Methoxybenzaldehyde mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

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Available MS Data

Used Instruments Orbitrap Fusion Lumos with ETD LBP
No. of Spectral Trees 1
No. of Spectra 248
Tandem Spectra MS1, MS2, MS3
Ionization Methods NSI
Analyzers FT
Last Modification 4/18/2017 8:22:01 AM
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Identificators

InChI InChI=1S/C8H8O2/c1-10-8-4-2-3-7(5-8)6-9/h2-6H,1H3
InChI Key WMPDAIZRQDCGFH-UHFFFAOYSA-N
Canonical SMILES COC1=CC=CC(=C1)C=O
CAS 591311
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Other Names m-Anisaldehyde;
m-Methoxybenzaldehyde;
Benzaldehyde, 3-methoxy-

In Other Databases

PubChem 11569
ChemSpider 21106184
ChEMBL CHEMBL22585
HMDb HMDB31459