Debug Info

object
{15}
_id
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1FN4WM7Jw0
spectrumID
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1FN4WM7Jw0
cost
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1
specType
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131072
xnmrNucleus
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dbLocation
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WMS3X:201334:1
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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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1-[(2S,6R)-6-[(2S)-2-hydroxypentyl]-2-piperidinyl]-2-propanone
SpectraBase Compound ID CSJoWHd2c7l
InChI InChI=1S/C13H25NO2/c1-3-5-13(16)9-12-7-4-6-11(14-12)8-10(2)15/h11-14,16H,3-9H2,1-2H3/t11-,12+,13-/m0/s1
InChIKey GFVMHSQLCIEXNG-XQQFMLRXSA-N
Mol Weight 227.35 g/mol
Molecular Formula C13H25NO2
Exact Mass 227.188529 g/mol
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Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1FN4WM7Jw0
Name 1-[(2S,6R)-6-[(2S)-2-hydroxypentyl]-2-piperidinyl]-2-propanone
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H25NO2
InChI InChI=1S/C13H25NO2/c1-3-5-13(16)9-12-7-4-6-11(14-12)8-10(2)15/h11-14,16H,3-9H2,1-2H3/t11-,12+,13-/m0/s1
InChIKey GFVMHSQLCIEXNG-XQQFMLRXSA-N
Molecular Weight 227.348 g/mol
SMILES N1[C@@](C[C@@](O)(CCC)[H])(CCC[C@]1(CC(=O)C)[H])[H]
SPLASH splash10-001l-7900000000-b86daa679646a24bd723
Source of Spectrum G4-63-764-5
Synonyms 1-[(2S,6R)-6-[(2S)-2-hydroxypentyl]-2-piperidyl]acetone 1-[(2S,6R)-6-[(2S)-2-hydroxypentyl]-2-piperidyl]propan-2-one 1-[(2S,6R)-6-[(2S)-2-hydroxypentyl]piperidin-2-yl]propan-2-one 1-[(2S,6R)-6-[(2S)-2-oxidanylpentyl]piperidin-2-yl]propan-2-one
Wiley ID 1608414
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