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trans-15-n-Butyl-16-methyldihydropyrene
SpectraBase Compound ID ptBA9b9imG
InChI InChI=1S/C21H22/c1-3-4-15-21-18-9-6-10-19(21)14-12-17-8-5-7-16(11-13-18)20(17,21)2/h5-14H,3-4,15H2,1-2H3
InChIKey WGXFMMUQWAHPMR-UHFFFAOYSA-N
Mol Weight 274.41 g/mol
Molecular Formula C21H22
Exact Mass 274.172151 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID jXaV4sPAe3
Name trans-15-n-Butyl-16-methyldihydropyrene
CAS Registry Number 64682-47-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H22
InChI InChI=1S/C21H22/c1-3-4-15-21-18-9-6-10-19(21)14-12-17-8-5-7-16(11-13-18)20(17,21)2/h5-14H,3-4,15H2,1-2H3
InChIKey WGXFMMUQWAHPMR-UHFFFAOYSA-N
Molecular Weight 274.407 g/mol
SMILES C12(C3(c4cccc3ccc1cccc2cc4)CCCC)C
SPLASH splash10-0udi-0090000000-54ff4283ccd47e1de9d5
Source of Spectrum J-43-730-0
Synonyms 10b-butyl-10c-methyl-10b,10c-dihydropyrene
Wiley ID 1278776