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PA-A11:0 [5-(3,4-Methylenedioxyphenyl)undecylpiperamide]
SpectraBase Compound ID bVUGkYulm9
InChI InChI=1S/C23H35NO3/c25-23(24-16-10-7-11-17-24)13-9-6-4-2-1-3-5-8-12-20-14-15-21-22(18-20)27-19-26-21/h14-15,18H,1-13,16-17,19H2
InChIKey QXBCJMFMJOLQNR-UHFFFAOYSA-N
Mol Weight 373.5 g/mol
Molecular Formula C23H35NO3
Exact Mass 373.261694 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8HhTraejMyk
Name PA-A11:0 [5-(3,4-Methylenedioxyphenyl)undecylpiperamide]
Alternate Name(s) 11-(1,3-benzodioxol-5-yl)-1-(1-piperidinyl)-1-undecanone 11-(1,3-benzodioxol-5-yl)-1-piperidin-1-ylundecan-1-one 11-(1,3-benzodioxol-5-yl)-1-(1-piperidyl)undecan-1-one 11-(1,3-benzodioxol-5-yl)-1-piperidin-1-yl-undecan-1-one
Comments Less than 3 mono-isotopic peaks
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Formula C23H35NO3
InChI InChI=1S/C23H35NO3/c25-23(24-16-10-7-11-17-24)13-9-6-4-2-1-3-5-8-12-20-14-15-21-22(18-20)27-19-26-21/h14-15,18H,1-13,16-17,19H2
InChIKey QXBCJMFMJOLQNR-UHFFFAOYSA-N
Molecular Weight 373.537 g/mol
SMILES C(N1CCCCC1)(=O)CCCCCCCCCCc1cc2OCOc2cc1
SPLASH splash10-004i-0903000000-dc4f7a7b89f9ea99dbe7
Source of Spectrum E1-45-694-0
Wiley ID 1553819