Ferulic acid

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Systematic / IUPAC Name: (2E)-3-(4-Hydroxy-3-methoxyphenyl)acrylic acid

ID: Reference421

Other Names: 4-Hydroxy-3-methoxycinnamic acid;
trans-4-Hydroxy-3-methoxycinnamic acid;
2-Propenoic acid, 3-(4-hydroxy-3-methoxyphenyl)-;
3-(4-Hydroxy-3-methoxyphenyl)acrylic acid;
Cinnamic acid, 4-hydroxy-3-methoxy- ; more

Formula: C10H10O4

Class: Endogenous Metabolites Excipients/Additives/Colorants

Spectral Data

Ferulic 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 Elite; Q Exactive Orbitrap
No. of Spectral Trees 5
No. of Spectra 601
Tandem Spectra MS1, MS2, MS3, MS4, MS5
Ionization Methods ESI; APCI
Analyzers FT
Last Modification 1/16/2015 3:12:50 PM
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Identificators

InChI InChI=1S/C10H10O4/c1-14-9-6-7(2-4-8(9)11)3-5-10(12)13/h2-6,11H,1H3,(H,12,13)/b5-3+
InChI Key KSEBMYQBYZTDHS-HWKANZROSA-N
Canonical SMILES COC1=C(C=CC(=C1)/C=C/C(=O)O)O
CAS 537984
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Other Names 4-Hydroxy-3-methoxycinnamic acid;
trans-4-Hydroxy-3-methoxycinnamic acid;
2-Propenoic acid, 3-(4-hydroxy-3-methoxyphenyl)-;
3-(4-Hydroxy-3-methoxyphenyl)acrylic acid;
Cinnamic acid, 4-hydroxy-3-methoxy-;
3-(4-Hydroxy-3-methoxyphenyl)-2-propenoic acid;
(2E)-3-(4-Hydroxy-3-methoxyphenyl)prop-2-enoic acid;
Cinnamic acid, 4-hydroxy-3-methoxy-, (E)-;
(E)-3-(4-Hydroxy-3-methoxyphenyl)-2-propenoic acid;
3-Methoxy-4-hydroxycinnamic acid;
2-Propenoic acid, 3-(4-hydroxy-3-methoxyphenyl)-, (E)-;
(E)-4-Hydroxy-3-methoxycinnamic acid;
3-(4-Hydroxy-3-methoxyphenyl)propenoic acid;
Cinnamic acid, 4-hydroxy-3-methoxy-, trans-;
(2E)-3-(4-Hydroxy-3-methoxyphenyl)-2-propenoic acid;
3-Methoxy-4-hydroxy-trans-cinnamic acid

In Other Databases

ChEMBL CHEMBL32749
PubChem 445858
ChEBI CHEBI:17620
HMDb HMDB00954
KEGG C01494
ChemIDPlus 000537984; 024276844; 097274618
Wikipedia Ferulic acid
ChemSpider 393368