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1-methyl-3-(3-carboxypropyl)fluoranthene
SpectraBase Compound ID 1xFOZf2Vvz9
InChI InChI=1S/C21H18O2/c1-13-12-14(6-4-11-19(22)23)15-9-5-10-18-16-7-2-3-8-17(16)20(13)21(15)18/h2-3,5,7-10,12H,4,6,11H2,1H3,(H,22,23)
InChIKey JQJVTNHVSUHXPF-UHFFFAOYSA-N
Mol Weight 302.37 g/mol
Molecular Formula C21H18O2
Exact Mass 302.13068 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7zfTDHFT5kz
Name 1-methyl-3-(3-carboxypropyl)fluoranthene
CAS Registry Number 95741-62-1
Comments Less than 3 mono-isotopic peaks
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Formula C21H18O2
InChI InChI=1S/C21H18O2/c1-13-12-14(6-4-11-19(22)23)15-9-5-10-18-16-7-2-3-8-17(16)20(13)21(15)18/h2-3,5,7-10,12H,4,6,11H2,1H3,(H,22,23)
InChIKey JQJVTNHVSUHXPF-UHFFFAOYSA-N
Molecular Weight 302.373 g/mol
SMILES OC(CCCc1cc(c-2c3c(cccc13)-c1c2cccc1)C)=O
SPLASH splash10-0fb9-0096000000-ba9e5ad944807346a667
Source of Spectrum J-50-1952-25
Synonyms 4-(1-methyl-3-fluoranthenyl)butanoic acid
Wiley ID 1305208