Debug Info

object
{15}
_id
:
wgRLDJBuNl
spectrumID
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wgRLDJBuNl
cost
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1
specType
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131072
xnmrNucleus
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dbLocation
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WMS3X:98954:1
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*, 2S*, 6R*)-5,5-dimethyl-2-(prop-2-en-1-yl)-7-oxabicyclo[4.1.0]heptan-2-ol
SpectraBase Compound ID EumlMy44lNG
InChI InChI=1S/C11H18O2/c1-4-5-11(12)7-6-10(2,3)8-9(11)13-8/h4,8-9,12H,1,5-7H2,2-3H3/t8-,9+,11+/m0/s1
InChIKey FHWDKRMRIPCFCY-IQJOONFLSA-N
Mol Weight 182.26 g/mol
Molecular Formula C11H18O2
Exact Mass 182.13068 g/mol
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Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID wgRLDJBuNl
Name (1R*, 2S*, 6R*)-5,5-dimethyl-2-(prop-2-en-1-yl)-7-oxabicyclo[4.1.0]heptan-2-ol
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H18O2
InChI InChI=1S/C11H18O2/c1-4-5-11(12)7-6-10(2,3)8-9(11)13-8/h4,8-9,12H,1,5-7H2,2-3H3/t8-,9+,11+/m0/s1
InChIKey FHWDKRMRIPCFCY-IQJOONFLSA-N
Literature Reference DOI 10.1021/ol1023757
Molecular Weight 182.263 g/mol
SMILES O[C@]1(CC=C)CCC(C)(C)[C@@]2([C@]1(O2)[H])[H]
SPLASH splash10-0006-2900000000-ae09b705e04a5ae7ff95
Source of Spectrum A1-12-5490/SMS9-2b
Synonyms (1R,2S,6R)-2-allyl-5,5-dimethyl-7-oxabicyclo[4.1.0]heptan-2-ol
Wiley ID 1752686
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