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1-Phenylpyrene
SpectraBase Compound ID D8a68jB7Ahb
InChI InChI=1S/C22H14/c1-2-5-15(6-3-1)19-13-11-18-10-9-16-7-4-8-17-12-14-20(19)22(18)21(16)17/h1-14H
InChIKey QRVQUBKLRBKFCG-UHFFFAOYSA-N
Mol Weight 278.35 g/mol
Molecular Formula C22H14
Exact Mass 278.10955 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6V7fGRuqY9f
Name 1-Phenylpyrene
CAS Registry Number 5101-27-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H14
InChI InChI=1S/C22H14/c1-2-5-15(6-3-1)19-13-11-18-10-9-16-7-4-8-17-12-14-20(19)22(18)21(16)17/h1-14H
InChIKey QRVQUBKLRBKFCG-UHFFFAOYSA-N
Molecular Weight 278.354 g/mol
SMILES c1cc2c3c(ccc4c(ccc(cc2)c34)-c2ccccc2)c1
SPLASH splash10-004i-0190000000-9dddf5e16f7178c9e9a4
Synonyms Pyrene, 1-phenyl-
Wiley ID 1502498