Debug Info

object
{15}
_id
:
IHaXEYXkH0t
spectrumID
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IHaXEYXkH0t
cost
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1
specType
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131072
xnmrNucleus
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0
dbLocation
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WMSL3X:79920:1
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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false
spectralOutlier
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compound
{10}
lastUpdated
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1735074081058
isDeprecated
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false

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1-Phenyl-4-(propan-2-ylidene)-2-((propylamino)methyl)pyrazolidine-3,5-dione
SpectraBase Compound ID BPOojUXzpb3
InChI InChI=1S/C16H21N3O2/c1-4-10-17-11-18-15(20)14(12(2)3)16(21)19(18)13-8-6-5-7-9-13/h5-9,17H,4,10-11H2,1-3H3
InChIKey KORKOYXMBUFXTD-UHFFFAOYSA-N
Mol Weight 287.36 g/mol
Molecular Formula C16H21N3O2
Exact Mass 287.163377 g/mol
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Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IHaXEYXkH0t
Name 1-Phenyl-4-(propan-2-ylidene)-2-((propylamino)methyl)pyrazolidine-3,5-dione
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H21N3O2
InChI InChI=1S/C16H21N3O2/c1-4-10-17-11-18-15(20)14(12(2)3)16(21)19(18)13-8-6-5-7-9-13/h5-9,17H,4,10-11H2,1-3H3
InChIKey KORKOYXMBUFXTD-UHFFFAOYSA-N
Molecular Weight 287.363 g/mol
SMILES N(CN1C(C(C(N1c1ccccc1)=O)=C(C)C)=O)CCC
SPLASH splash10-0006-0090000000-db20f8134224974f2ac0
Source of Spectrum QA-51-105-21a
Wiley ID 1795865
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