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3,4-Dihydroxyphenyl-PA-C7:0 [7-(3,4-Dihydroxyphenyl)heptylpyrrolidinamide]
SpectraBase Compound ID 1rakMsN6lbJ
InChI InChI=1S/C17H25NO3/c19-15-10-9-14(13-16(15)20)7-3-1-2-4-8-17(21)18-11-5-6-12-18/h9-10,13,19-20H,1-8,11-12H2
InChIKey JDQSABPBGFWEGR-UHFFFAOYSA-N
Mol Weight 291.39 g/mol
Molecular Formula C17H25NO3
Exact Mass 291.183444 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 78FlZxaPdum
Name 3,4-Dihydroxyphenyl-PA-C7:0 [7-(3,4-Dihydroxyphenyl)heptylpyrrolidinamide]
Comments Less than 3 mono-isotopic peaks
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Formula C17H25NO3
InChI InChI=1S/C17H25NO3/c19-15-10-9-14(13-16(15)20)7-3-1-2-4-8-17(21)18-11-5-6-12-18/h9-10,13,19-20H,1-8,11-12H2
InChIKey JDQSABPBGFWEGR-UHFFFAOYSA-N
Molecular Weight 291.391 g/mol
SMILES Oc1cc(ccc1O)CCCCCCC(N1CCCC1)=O
SPLASH splash10-03dl-0970000000-9956e6122350686b9c68
Source of Spectrum E1-45-695-0
Synonyms 7-(3,4-dihydroxyphenyl)-1-(1-pyrrolidinyl)-1-heptanone 7-(3,4-dihydroxyphenyl)-1-pyrrolidin-1-ylheptan-1-one 7-(3,4-dihydroxyphenyl)-1-pyrrolidin-1-yl-heptan-1-one 7-[3,4-bis(oxidanyl)phenyl]-1-pyrrolidin-1-yl-heptan-1-one
Wiley ID 1553880