1,2,4-Trimethoxybenzene

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Systematic / IUPAC Name: 1,2,4-Trimethoxybenzene

ID: Reference13960

Other Names: AA-4774

Formula: C9H12O3

Class: Endogenous Metabolites

Spectral Data

1,2,4-Trimethoxybenzene 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 ID-X with ETD_Cal Gateshead
No. of Spectral Trees 1
No. of Spectra 1020
Tandem Spectra MS1, MS2, MS3, MS4
Ionization Methods NSI
Analyzers FT
Last Modification 6/26/2026 2:05:31 PM
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Identificators

InChI InChI=1S/C9H12O3/c1-10-7-4-5-8(11-2)9(6-7)12-3/h4-6H,1-3H3
InChI Key AGIQIOSHSMJYJP-UHFFFAOYSA-N
Canonical SMILES COc1ccc(OC)c(OC)c1
CAS
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Other Names AA-4774

In Other Databases

ChEMBL CHEMBL1668605
PubChem 67284; 67284
ChemSpider 425; 60616