Spectrum CCMSLIB00004684207 for Linoleoyl Ethanolamide

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Compound Information

Chemical Names

Compound Classification (provided by ClassyFire)

ClassyFire is a freely accessible computational tool that uses the ChemOnt taxonomy to classify chemical entities based on their structure. ClassyFire combines structure search, IUPAC name parsing, and evaluation of logical expressions to retrieve structural features, which are then mapped to the corresponding ChemOnt classes.

Compound Metadata

NameValue
C20H37NO2
323.282429424
O=C(NCCO)CCCCCCCC=CCC=CCCCCC
InChI=1S/C20H37NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-20(23)21-18-19-22/h6-7,9-10,22H,2-5,8,11-19H2,1H3,(H,21,23)/b7-6-,10-9-
KQXDGUVSAAQARU-HZJYTTRNSA-N

Mass Spectral Metadata

NameValue
LC-ESI
Commercial
qTof
0.0
1
f.lfnothias/1807_Psoriasis/mzXML/1809_Psoriasis_confirmation/BD1_Mix2_20x_BD2_01_15757.mzML;
MS2
GNPS-LIBRARY
Dorrestein, lfnothias
positive
2.345645219656364
0.35667240531241995
324.289
[M+H]+
4.315360681363897 ppm
-0.0013994239999988167 Da