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PA-A7:0 [5-(3,4-Methylenedioxyphenyl)heptylpiperamide]
SpectraBase Compound ID KKsuuchn4NB
InChI InChI=1S/C19H27NO3/c21-19(20-12-6-3-7-13-20)9-5-2-1-4-8-16-10-11-17-18(14-16)23-15-22-17/h10-11,14H,1-9,12-13,15H2
InChIKey AEYQYNZTXHXTKJ-UHFFFAOYSA-N
Mol Weight 317.43 g/mol
Molecular Formula C19H27NO3
Exact Mass 317.199094 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7V0fdIbtZJZ
Name PA-A7:0 [5-(3,4-Methylenedioxyphenyl)heptylpiperamide]
Alternate Name(s) 7-(1,3-benzodioxol-5-yl)-1-(1-piperidinyl)-1-heptanone 7-(1,3-benzodioxol-5-yl)-1-piperidin-1-ylheptan-1-one 7-(1,3-benzodioxol-5-yl)-1-(1-piperidyl)heptan-1-one 7-(1,3-benzodioxol-5-yl)-1-piperidin-1-yl-heptan-1-one
Comments Less than 3 mono-isotopic peaks
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Formula C19H27NO3
InChI InChI=1S/C19H27NO3/c21-19(20-12-6-3-7-13-20)9-5-2-1-4-8-16-10-11-17-18(14-16)23-15-22-17/h10-11,14H,1-9,12-13,15H2
InChIKey AEYQYNZTXHXTKJ-UHFFFAOYSA-N
Molecular Weight 317.429 g/mol
SMILES C(N1CCCCC1)(=O)CCCCCCc1cc2OCOc2cc1
SPLASH splash10-00or-0908000000-a0d7092f4e7c91b7d7e0
Source of Spectrum E1-45-693-0
Wiley ID 1553835