Dataset

Ephedrine

This MassBank record with Accession MSBNK-Washington_State_Univ-BML81165 contains the MS mass spectrum of Ephedrine with the InChIkey KWGRBVOPPLSCSI-UHFFFAOYSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C10H15NO/c1-8(11-2)10(12)9-6-4-3-5-7-9/h3-8,10-12H,1-2H3
SMILES CC(C(C1=CC=CC=C1)O)NC
InChI Key KWGRBVOPPLSCSI-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-sa/4.0
Source https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Washington_State_Univ-BML81165
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T22:24:25.629619
MetadataModified 2024-01-11T22:24:25.793884
MetadataPublished 2016-01-19
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
975520 eMolecules
5032 PubChem
MCULE-9848295327 Mcule
SCHEMBL4369 SureChEMBL
70102975 NMRShiftDB
38732-95-5 ACToR
134-72-5 ACToR
90-81-3 ACToR
PD062884 ProbesDrugs
14748094 PubChem: Thomson Pharma
299-42-3 ACToR
53214-57-6 ACToR
90-82-4 ACToR
321-98-2 ACToR
LSM-1633 LINCS
20259 Brenda
90188 Brenda
86284 BindingDB
HMDB0246924 Human Metabolome Database
EPHEDR CCDC
J69.045G Nikkaji
CHEMBL279157 ChEMBL
The data in this table is sourced from UniChem at EBI.