Debug Info

object
{15}
_id
:
DBSEBsBCvC5
spectrumID
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DBSEBsBCvC5
cost
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1
specType
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131072
xnmrNucleus
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dbLocation
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WMS3X:362579:1
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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1-(4-Chlorophenyl)-3,3,3-trifluoro-1-phenylpropan-1-ol
SpectraBase Compound ID BGggfvTEx3I
InChI InChI=1S/C15H12ClF3O/c16-13-8-6-12(7-9-13)14(20,10-15(17,18)19)11-4-2-1-3-5-11/h1-9,20H,10H2
InChIKey KHRRIUUYROCWAQ-UHFFFAOYSA-N
Mol Weight 300.71 g/mol
Molecular Formula C15H12ClF3O
Exact Mass 300.052877 g/mol
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Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DBSEBsBCvC5
Name 1-(4-Chlorophenyl)-3,3,3-trifluoro-1-phenylpropan-1-ol
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H12ClF3O
InChI InChI=1S/C15H12ClF3O/c16-13-8-6-12(7-9-13)14(20,10-15(17,18)19)11-4-2-1-3-5-11/h1-9,20H,10H2
InChIKey KHRRIUUYROCWAQ-UHFFFAOYSA-N
Molecular Weight 300.708 g/mol
SMILES OC(CC(F)(F)F)(c1ccc(cc1)Cl)c1ccccc1
SPLASH splash10-014r-1791000000-d0ff478f88bcd5aa7717
Source of Spectrum U1-2013-1141-4m
Synonyms 1-(4-Chlorophenyl)-3,3,3-trifluoro-1-phenyl-1-propanol 1-(4-Chlorophenyl)-3,3,3-tris(fluoranyl)-1-phenyl-propan-1-ol
Wiley ID 1735736
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