Spectrum CCMSLIB00000078363 for Nefiracetam (Translon)

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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
77191-36-7
C14H18N2O2
246.136827816
O=C(NC=1C(=CC=CC1C)C)CN2C(=O)CCC2
InChI=1S/C14H18N2O2/c1-10-5-3-6-11(2)14(10)15-12(17)9-16-8-4-7-13(16)18/h3,5-6H,4,7-9H2,1-2H3,(H,15,17)
NGHTXZCKLWZPGK-UHFFFAOYSA-N

Mass Spectral Metadata

NameValue
LC-ESI
Commercial
qTof
246.137
1
MS2
Plate5_61_88_GH9_01_16511.mzXML
GNPS-SELLECKCHEM-FDA-PART2
negarg, Garg_Neha, Dorrestein
positive
3.596910813061499
0.7880447902255192
247.144
[M+H]+
3.228142297559159 ppm
-7.978159999879608E-4 Da