Debug Info

object
{15}
_id
:
34PuDgFnDBD
spectrumID
:
34PuDgFnDBD
cost
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1
specType
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131072
xnmrNucleus
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0
dbLocation
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WMSL3X:60500:1
hasStructureAssignments
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false
properties
{11}
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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4-Propylidene-3-[(3-isopropoxycarbonyl)propyl]cyclohex-2-en-1-one
SpectraBase Compound ID Bok2pUZoArD
InChI InChI=1S/C16H24O3/c1-4-6-13-9-10-15(17)11-14(13)7-5-8-16(18)19-12(2)3/h6,11-12H,4-5,7-10H2,1-3H3/b13-6-
InChIKey ANVPJLPIDKMLNY-MLPAPPSSSA-N
Mol Weight 264.36 g/mol
Molecular Formula C16H24O3
Exact Mass 264.172545 g/mol
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Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 34PuDgFnDBD
Name 4-Propylidene-3-[(3-isopropoxycarbonyl)propyl]cyclohex-2-en-1-one
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H24O3
InChI InChI=1S/C16H24O3/c1-4-6-13-9-10-15(17)11-14(13)7-5-8-16(18)19-12(2)3/h6,11-12H,4-5,7-10H2,1-3H3/b13-6-
InChIKey ANVPJLPIDKMLNY-MLPAPPSSSA-N
Molecular Weight 264.365 g/mol
SMILES C=1(\C(CCC(C1)=O)=C/CC)CCCC(=O)OC(C)C
SPLASH splash10-03di-4590000000-e4660998527d9b7d045d
Source of Spectrum SK-26-954-13
Synonyms 4-(1'-Propenyl)-3-[(isopropoxycarbonyl)propyl]cyclohex-2-en-1-one isopropyl 4-[(6Z)-3-oxo-6-propylidene-1-cyclohexen-1-yl]butanoate
Wiley ID 867123
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