CHEBI:230175 - 2-(3,4-Dimethoxyphenyl)-3-fluoroallylamine

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name 2-(3,4-Dimethoxyphenyl)-3-fluoroallylamine
ChEBI ID CHEBI:230175
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C11H14FNO2
Net Charge 0
Average Mass 211.236
Monoisotopic Mass 211.10086
InChI InChI=1S/C11H14FNO2/c1-14-10-4-3-8(5-11(10)15-2)9(6-12)7-13/h3-6H,7,13H2,1-2H3/b9-6-
InChIKey HLNSVKSSCLHOSW-TWGQIWQCSA-N
SMILES F/C=C(\C1=CC(OC)=C(OC)C=C1)/CN
Metabolite of Species Details
Mus musculus (NCBI:txid10090) Found in feces (BTO:0000440). See: MetaboLights Study
ChEBI Ontology
Outgoing 2-(3,4-Dimethoxyphenyl)-3-fluoroallylamine (CHEBI:230175) is a dimethoxybenzene (CHEBI:51681)
IUPAC Name
(E)-2-(3,4-dimethoxyphenyl)-3-luoroprop-2-en-1-amine
Manual Xref Database
4942864 ChemSpider
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