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5-(1-pyrenyl)-2-pentanone

View entire compound with spectra: 1 MS (GC)

5-(1-pyrenyl)-2-pentanone
SpectraBase Compound ID 4ecXiyfS53J
InChI InChI=1S/C21H18O/c1-14(22)4-2-5-15-8-9-18-11-10-16-6-3-7-17-12-13-19(15)21(18)20(16)17/h3,6-13H,2,4-5H2,1H3
InChIKey BJABHYXSQRGXSR-UHFFFAOYSA-N
Mol Weight 286.37 g/mol
Molecular Formula C21H18O
Exact Mass 286.135765 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8uTEcAR4KDo
Name 5-(1-pyrenyl)-2-pentanone
Alternate Name(s) 5-Pyren-1-ylpentan-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H18O
InChI InChI=1S/C21H18O/c1-14(22)4-2-5-15-8-9-18-11-10-16-6-3-7-17-12-13-19(15)21(18)20(16)17/h3,6-13H,2,4-5H2,1H3
InChIKey BJABHYXSQRGXSR-UHFFFAOYSA-N
Molecular Weight 286.374 g/mol
SMILES c12c3ccc4c2c(ccc4)ccc1ccc3CCCC(=O)C
SPLASH splash10-0170-1090000000-81787dea1d6b76032c59
Source of Spectrum U1-2003-3172-16
Wiley ID 1523788