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trans-1-(4-Acetylphenyl)-10b,10c-dimethyl-10b,10c-dihydropyrene
SpectraBase Compound ID 4YIOvJ9djj
InChI InChI=1S/C26H22O/c1-17(27)18-7-9-19(10-8-18)23-15-13-22-12-11-20-5-4-6-21-14-16-24(23)26(22,3)25(20,21)2/h4-16H,1-3H3/t25-,26-/m0/s1
InChIKey YRJCGQQHCRNSAC-UIOOFZCWSA-N
Mol Weight 350.46 g/mol
Molecular Formula C26H22O
Exact Mass 350.167065 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FZBbvMhODNw
Name trans-1-(4-Acetylphenyl)-10b,10c-dimethyl-10b,10c-dihydropyrene
Alternate Name(s) 1-{4-[(10bS,10cS)-10b,10c-dimethyl-10b,10c-dihydro-1-pyrenyl]phenyl}ethanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H22O
InChI InChI=1S/C26H22O/c1-17(27)18-7-9-19(10-8-18)23-15-13-22-12-11-20-5-4-6-21-14-16-24(23)26(22,3)25(20,21)2/h4-16H,1-3H3/t25-,26-/m0/s1
InChIKey YRJCGQQHCRNSAC-UIOOFZCWSA-N
Molecular Weight 350.461 g/mol
SMILES [C@]12(c3c(-c4ccc(cc4)C(=O)C)ccc1ccc1[C@]2(c(cc3)ccc1)C)C
SPLASH splash10-000i-0239000000-00355234d7669fc88e2b
Source of Spectrum J-62-4416-8
Wiley ID 1342391