Debug Info

object
{15}
_id
:
AzZGiS2M0w4
spectrumID
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AzZGiS2M0w4
cost
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1
specType
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131072
xnmrNucleus
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dbLocation
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WMSL3X:101976:1
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)
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spectralOutlier
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compound
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lastUpdated
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1735074081058
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2-(1,2,3,6,7,8-Hexahydro-4-pyrenyl)benzaldehyde
SpectraBase Compound ID 29VHboQXQvL
InChI InChI=1S/C23H20O/c24-14-18-5-1-2-9-19(18)21-13-17-8-3-6-15-11-12-16-7-4-10-20(21)23(16)22(15)17/h1-2,5,9,11-14H,3-4,6-8,10H2
InChIKey PDDJKXHNLZKOAW-UHFFFAOYSA-N
Mol Weight 312.41 g/mol
Molecular Formula C23H20O
Exact Mass 312.151415 g/mol
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Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AzZGiS2M0w4
Name 2-(1,2,3,6,7,8-Hexahydro-4-pyrenyl)benzaldehyde
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H20O
InChI InChI=1S/C23H20O/c24-14-18-5-1-2-9-19(18)21-13-17-8-3-6-15-11-12-16-7-4-10-20(21)23(16)22(15)17/h1-2,5,9,11-14H,3-4,6-8,10H2
InChIKey PDDJKXHNLZKOAW-UHFFFAOYSA-N
Molecular Weight 312.412 g/mol
SMILES c1(c2c3c(ccc4c3c(c1)CCC4)CCC2)-c1c(C=O)cccc1
SPLASH splash10-03di-0097000000-5370f754278b3f1b6bbd
Source of Spectrum SO-0-843-8
Wiley ID 863911
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