Dataset

4-Methoxyamphetamine

This MassBank record with Accession MSBNK-Waters-WA002861 contains the MS mass spectrum of 4-Methoxyamphetamine with the InChIkey NEGYEDYHPHMHGK-UHFFFAOYSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C10H15NO/c1-8(11)7-9-3-5-10(12-2)6-4-9/h3-6,8H,7,11H2,1-2H3
SMILES COc(c1)ccc(CC(C)N)c1
InChI Key NEGYEDYHPHMHGK-UHFFFAOYSA-N
Molecular Formula C10H15NO
Exact Mass 165.115 g/mol

Data and Resources

Metadata Information

Field Value
DOI
License URL https://creativecommons.org/licenses/by-nc/4.0
Source https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Waters-WA002861
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T22:49:24.074818
MetadataModified 2024-01-11T22:49:24.246401
MetadataPublished 2016-01-19
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
MCULE-9604730500 Mcule
OVB8F8P39Q FDA SRS
50024209 BindingDB
DTXSID7040578 EPA CompTox Dashboard
SCHEMBL264634 SureChEMBL
J213.549C Nikkaji
HMDB0246494 Human Metabolome Database
CHEMBL278663 ChEMBL
DB01472 DrugBank
39741 Brenda
38543 Brenda
977554 eMolecules
31721 PubChem
60027263 NMRShiftDB
15194941 PubChem: Thomson Pharma
23239-32-9 ACToR
64-13-1 ACToR
PD008842 ProbesDrugs
The data in this table is sourced from UniChem at EBI.