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(E)-7-Naphthalen-2-yl-5-oxohept-6-enoic acid
SpectraBase Compound ID 8HxgfTMUEvR
InChI InChI=1S/C17H16O3/c18-16(6-3-7-17(19)20)11-9-13-8-10-14-4-1-2-5-15(14)12-13/h1-2,4-5,8-12H,3,6-7H2,(H,19,20)/b11-9+
InChIKey NKWVJBIWWHOTRE-PKNBQFBNSA-N
Mol Weight 268.31 g/mol
Molecular Formula C17H16O3
Exact Mass 268.109944 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2aIxHN9sfn7
Name (E)-7-Naphthalen-2-yl-5-oxohept-6-enoic acid
Comments Less than 3 mono-isotopic peaks
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Formula C17H16O3
InChI InChI=1S/C17H16O3/c18-16(6-3-7-17(19)20)11-9-13-8-10-14-4-1-2-5-15(14)12-13/h1-2,4-5,8-12H,3,6-7H2,(H,19,20)/b11-9+
InChIKey NKWVJBIWWHOTRE-PKNBQFBNSA-N
Molecular Weight 268.312 g/mol
SMILES OC(CCCC(\C=C\c1cc2ccccc2cc1)=O)=O
SPLASH splash10-001i-0900000000-ef15ad1f9b184576b5ba
Source of Spectrum G2-18-8474-4
Synonyms (E)-7-(2-naphthalenyl)-5-oxo-6-heptenoic acid (E)-7-(2-naphthyl)-5-oxo-hept-6-enoic acid (E)-7-naphthalen-2-yl-5-oxidanylidene-hept-6-enoic acid
Wiley ID 1662030