Debug Info

object
{15}
_id
:
I4lX5aIh90e
spectrumID
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I4lX5aIh90e
cost
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1
specType
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131072
xnmrNucleus
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dbLocation
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WMS3X:123832:1
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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(1R*,3S*,4S*,6R*)-3,4-Epoxy-6,9,9-trimethylbicyclo[4.2.1]nonan-2-one
SpectraBase Compound ID KJRZzgedTRJ
InChI InChI=1S/C12H18O2/c1-11(2)7-4-5-12(11,3)6-8-10(14-8)9(7)13/h7-8,10H,4-6H2,1-3H3/t7-,8-,10-,12+/m0/s1
InChIKey GITDNEIKUMPRKK-PRLGWJNPSA-N
Mol Weight 194.27 g/mol
Molecular Formula C12H18O2
Exact Mass 194.13068 g/mol
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Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID I4lX5aIh90e
Name (1R*,3S*,4S*,6R*)-3,4-Epoxy-6,9,9-trimethylbicyclo[4.2.1]nonan-2-one
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H18O2
InChI InChI=1S/C12H18O2/c1-11(2)7-4-5-12(11,3)6-8-10(14-8)9(7)13/h7-8,10H,4-6H2,1-3H3/t7-,8-,10-,12+/m0/s1
InChIKey GITDNEIKUMPRKK-PRLGWJNPSA-N
Molecular Weight 194.274 g/mol
SMILES [C@]12(O[C@]2(C[C@]2(C)C([C@](C1=O)(CC2)[H])(C)C)[H])[H]
SPLASH splash10-052b-6900000000-5aca220fb8e1f86ca187
Source of Spectrum J-60-3327-41
Synonyms (1R,3S,5S,7R)-7,10,10-trimethyl-4-oxatricyclo[5.2.1.0(3,5)]decan-2-one
Wiley ID 1191250
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