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3,4-Dimethoxyphenyl-PA-C15:0 [5-(3,4-Dimethoxyphenyl)pentadecylpyrrolidinamide]
SpectraBase Compound ID KBG5VWcjOnh
InChI InChI=1S/C27H45NO3/c1-30-25-20-19-24(23-26(25)31-2)17-13-11-9-7-5-3-4-6-8-10-12-14-18-27(29)28-21-15-16-22-28/h19-20,23H,3-18,21-22H2,1-2H3
InChIKey WCVDITANKHGYKN-UHFFFAOYSA-N
Mol Weight 431.7 g/mol
Molecular Formula C27H45NO3
Exact Mass 431.339944 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3DZCT7oVaC
Name 3,4-Dimethoxyphenyl-PA-C15:0 [5-(3,4-Dimethoxyphenyl)pentadecylpyrrolidinamide]
Alternate Name(s) 15-(3,4-dimethoxyphenyl)-1-(1-pyrrolidinyl)-1-pentadecanone 15-(3,4-dimethoxyphenyl)-1-pyrrolidin-1-ylpentadecan-1-one 15-(3,4-dimethoxyphenyl)-1-pyrrolidin-1-yl-pentadecan-1-one
Comments Less than 3 mono-isotopic peaks
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Formula C27H45NO3
InChI InChI=1S/C27H45NO3/c1-30-25-20-19-24(23-26(25)31-2)17-13-11-9-7-5-3-4-6-8-10-12-14-18-27(29)28-21-15-16-22-28/h19-20,23H,3-18,21-22H2,1-2H3
InChIKey WCVDITANKHGYKN-UHFFFAOYSA-N
Molecular Weight 431.661 g/mol
SMILES C(N1CCCC1)(=O)CCCCCCCCCCCCCCc1cc(OC)c(cc1)OC
SPLASH splash10-01q9-0700900000-a14f8e57f8488f53eb54
Source of Spectrum E1-45-694-0
Wiley ID 1553795