Debug Info

object
{15}
_id
:
21NRkPNiCG
spectrumID
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21NRkPNiCG
cost
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1
specType
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131072
xnmrNucleus
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dbLocation
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WMS3X:476893:1
hasStructureAssignments
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properties
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analyticalTechnique
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MS (GC)
analyticalTechniqueLongName
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Mass Spectrum (GC)
isFullSpectrum
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spectralOutlier
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compound
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lastUpdated
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1735074081058
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false

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Ethyl docosanoate
SpectraBase Compound ID GkiCSj2MewB
InChI InChI=1S/C24H48O2/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24(25)26-4-2/h3-23H2,1-2H3
InChIKey JIZCYLOUIAIZHQ-UHFFFAOYSA-N
Mol Weight 368.6 g/mol
Molecular Formula C24H48O2
Exact Mass 368.365431 g/mol
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Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 21NRkPNiCG
Name Ethyl docosanoate
CAS Registry Number 5908-87-2
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H48O2
InChI InChI=1S/C24H48O2/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24(25)26-4-2/h3-23H2,1-2H3
InChIKey JIZCYLOUIAIZHQ-UHFFFAOYSA-N
Molecular Weight 368.646 g/mol
SMILES C(=O)(CCCCCCCCCCCCCCCCCCCCC)OCC
SPLASH splash10-0pbl-9100000000-4d3058d1baf2aa2ab5d7
Source of Spectrum HE-1986-29-0
Synonyms behenic acid ethyl ester Docosanoic acid ethyl ester EINECS 227-616-4
Wiley ID 1353384
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