Dataset

N,N-Diethyl-4-methoxybenzamide

This MassBank record with Accession MSBNK-Fiocruz-FIO00371 contains the MS2 mass spectrum of N,N-Diethyl-4-methoxybenzamide with the InChIkey HCJXEOFLVIFFDG-UHFFFAOYSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C12H17NO2/c1-4-13(5-2)12(14)10-6-8-11(15-3)9-7-10/h6-9H,4-5H2,1-3H3
SMILES COc(c1)ccc(c1)C(=O)N(CC)CC
InChI Key HCJXEOFLVIFFDG-UHFFFAOYSA-N
Molecular Formula C12H17NO2
Exact Mass 207.126 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-Fiocruz-FIO00371
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T16:36:47.616343
MetadataModified 2024-01-11T16:36:47.801871
MetadataPublished 2016-01-19
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
DTXSID10282734 EPA CompTox Dashboard
ZINC000000029526 ZINC
SCHEMBL1844719 SureChEMBL
J419.203F Nikkaji
MCULE-6786038311 Mcule
MolPort-001-490-251 MolPort
1061746 eMolecules
7465-86-3 ACToR
16509153 PubChem: Thomson Pharma
231459 PubChem
181003 ChEBI
The data in this table is sourced from UniChem at EBI.