Debug Info

object
{15}
_id
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EFRxvWVKaGo
spectrumID
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EFRxvWVKaGo
cost
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1
specType
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131072
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dbLocation
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WMS3X:68611:1
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MS (GC)
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Mass Spectrum (GC)
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spectralOutlier
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compound
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2H-Cyclohepta[b]furan-2-one, 4,5,6,7,8,8a-hexahydro-3-methyl-
SpectraBase Compound ID IfywR0eFS7J
InChI InChI=1S/C10H14O2/c1-7-8-5-3-2-4-6-9(8)12-10(7)11/h9H,2-6H2,1H3
InChIKey UUCKKNURKAQCOB-UHFFFAOYSA-N
Mol Weight 166.22 g/mol
Molecular Formula C10H14O2
Exact Mass 166.09938 g/mol
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Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EFRxvWVKaGo
Name 2H-Cyclohepta[b]furan-2-one, 4,5,6,7,8,8a-hexahydro-3-methyl-
CAS Registry Number 107115-58-2
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H14O2
InChI InChI=1S/C10H14O2/c1-7-8-5-3-2-4-6-9(8)12-10(7)11/h9H,2-6H2,1H3
InChIKey UUCKKNURKAQCOB-UHFFFAOYSA-N
Molecular Weight 166.220 g/mol
SMILES C1(C(=C2CCCCCC2O1)C)=O
SPLASH splash10-014s-9800000000-7d70dc7ca825358054ea
Source of Spectrum J-52-1436-15
Synonyms 3-Methyl-4,5,6,7,8,8a-hexahydro-2H-cyclohepta[b]furan-2-one 3-Methyl-4,5,6,7,8,8a.alpha.-hexahydro-2H-cyclohepta[b]furan-2-one
Wiley ID 1162687
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