Dataset

N,N-Diethyl-2-methoxybenzamide

This MassBank record with Accession MSBNK-Fiocruz-FIO00400 contains the MS2 mass spectrum of N,N-Diethyl-2-methoxybenzamide with the InChIkey ZFIIUAIWXACNKN-UHFFFAOYSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C12H17NO2/c1-4-13(5-2)12(14)10-8-6-7-9-11(10)15-3/h6-9H,4-5H2,1-3H3
SMILES CCN(CC)C(=O)c(c1)c(OC)ccc1
InChI Key ZFIIUAIWXACNKN-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-FIO00400
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T16:37:25.600427
MetadataModified 2024-01-11T16:37:25.768054
MetadataPublished 2016-01-19
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
ZINC000000475817 ZINC
346975 PubChem
2199638 eMolecules
16167576 PubChem: Thomson Pharma
51674-10-3 ACToR
MCULE-5554438034 Mcule
DTXSID00323988 EPA CompTox Dashboard
KUVKIY CCDC
J1.968.984K Nikkaji
SCHEMBL812080 SureChEMBL
The data in this table is sourced from UniChem at EBI.