3,4,5-Trimethoxycinnamic acid

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Systematic / IUPAC Name: (E)-3-(3,4,5-Trimethoxyphenyl)prop-2-enoic acid

ID: Reference13635

Other Names: (E)-3-(3,4,5-Trimethoxyphenyl)acrylic acid;
AA-3679

Formula: C12H14O5

Class: Endogenous Metabolites

Spectral Data

3,4,5-Trimethoxycinnamic acid 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 2
No. of Spectra 3470
Tandem Spectra MS1, MS2, MS3, MS4, MS5, MS6, MS7, MS8
Ionization Methods NSI
Analyzers FT
Last Modification 11/10/2025 12:42:05 PM
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Identificators

InChI InChI=1S/C12H14O5/c1-15-9-6-8(4-5-11(13)14)7-10(16-2)12(9)17-3/h4-7H,1-3H3,(H,13,14)/b5-4+
InChI Key YTFVRYKNXDADBI-SNAWJCMRSA-N
Canonical SMILES COc1cc(/C=C/C(=O)O)cc(OC)c1OC
CAS
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Other Names (E)-3-(3,4,5-Trimethoxyphenyl)acrylic acid;
AA-3679

In Other Databases

ChEMBL CHEMBL501235
HMDb HMDB0002511
PubChem 735755
ChemSpider 642910