Dataset

Crotetamide; LC-ESI-QFT; MS2; CE: 45; R=35000; [M+H]+

This MassBank record with Accession MSBNK-Eawag-EQ318703 contains the MS2 mass spectrum of Crotetamide with the InChIkey LSAMUAYPDHUBQD-RMKNXTFCSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C12H22N2O2/c1-6-9-11(15)14(8-3)10(7-2)12(16)13(4)5/h6,9-10H,7-8H2,1-5H3/b9-6+
SMILES O=C(N(CC)C(C(=O)N(C)C)CC)/C=C/C
InChI Key LSAMUAYPDHUBQD-RMKNXTFCSA-N
Molecular Formula C12H22N2O2
Exact Mass 226.168 g/mol

Data and Resources

Metadata Information

Field Value
DOI
License URL https://creativecommons.org/licenses/by/4.0
Source https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Eawag-EQ318703
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Maintainer
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MetadataPublished 2015-08-25
Related Molecule
  • 2-[[(E)-but-2-enoyl]-ethylamino]-N,N-dimethylbutanamide
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    PD073577 ProbesDrugs
    6168-76-9 ACToR
    15488893 PubChem: Thomson Pharma
    CHEMBL2104177 ChEMBL
    SCHEMBL26013 SureChEMBL
    DTXSID60891471 EPA CompTox Dashboard
    745 DrugCentral
    642I97LB5B FDA SRS
    134931 ChEBI
    J8.352F Nikkaji
    5368010 PubChem
    The data in this table is sourced from UniChem at EBI.