Spectrum FiehnHILIC001640 for 2-Palmitoylglycerol

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  • Originally submitted to the Fiehn Lab HILIC Library

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
BBNYCLAREVXOSG-UHFFFAOYSA-N
C19H38O4
330.277009696
O=C(OC(CO)CO)CCCCCCCCCCCCCCC
InChI=1S/C19H38O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-19(22)23-18(16-20)17-21/h18,20-21H,2-17H2,1H3

Mass Spectral Metadata

NameValue
0.9874
M + 0
67
15 eV
positive
35 eV
LC-ESI-QTOF
SCIEX TripleTOF 6600
Michael Sa and Megan Showalter
MS2
Waters Acquity UPLC BEH Amide column (2.1 x 150mm: 1.7µm)
2.7099042238927487
0.9203465390408303
331.2839
[M+H]+
3.2591260848371837 ppm
-0.0010796959999765932 Da