Debug Info

object
{15}
_id
:
1qbrl8IDDcT
spectrumID
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1qbrl8IDDcT
cost
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1
specType
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131072
xnmrNucleus
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0
dbLocation
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WDD1X:12820:1
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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false
compound
{10}
lastUpdated
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1735074081058
isDeprecated
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false

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Anisole
SpectraBase Compound ID HB4DMFeGv80
InChI InChI=1S/C7H8O/c1-8-7-5-3-2-4-6-7/h2-6H,1H3
InChIKey RDOXTESZEPMUJZ-UHFFFAOYSA-N
Mol Weight 108.14 g/mol
Molecular Formula C7H8O
Exact Mass 108.057515 g/mol
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Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1qbrl8IDDcT
Name Methoxybenzene
CAS Registry Number 100-66-3
Classification Chemical
Copyright Copyright © 2024-2025 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 108.057514877 u
Formula C7H8O
InChI InChI=1S/C7H8O/c1-8-7-5-3-2-4-6-7/h2-6H,1H3
InChIKey RDOXTESZEPMUJZ-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 108.140 g/mol
Nominal Mass 108 u
Quality 996
Retention Index 794
SMILES C1(=CC=CC=C1)OC
SPLASH splash10-05r0-9300000000-8cacde46eab4796cbe3e
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms methoxybenzene
Technique GC/MS
Wiley ID DD2024_012820
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