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3,4-Dimethoxyphenyl-PA-C9:0 [5-(3,4-DimethoxyphenylOnonylpyrrolidinamide]
SpectraBase Compound ID K5Fcb6sFlx
InChI InChI=1S/C21H33NO3/c1-24-19-14-13-18(17-20(19)25-2)11-7-5-3-4-6-8-12-21(23)22-15-9-10-16-22/h13-14,17H,3-12,15-16H2,1-2H3
InChIKey CNQWQJWFBRGCPO-UHFFFAOYSA-N
Mol Weight 347.5 g/mol
Molecular Formula C21H33NO3
Exact Mass 347.246044 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3HWZYJrleSF
Name 3,4-Dimethoxyphenyl-PA-C9:0 [5-(3,4-DimethoxyphenylOnonylpyrrolidinamide]
Alternate Name(s) 9-(3,4-dimethoxyphenyl)-1-(1-pyrrolidinyl)-1-nonanone 9-(3,4-dimethoxyphenyl)-1-pyrrolidin-1-ylnonan-1-one 9-(3,4-dimethoxyphenyl)-1-pyrrolidin-1-yl-nonan-1-one
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H33NO3
InChI InChI=1S/C21H33NO3/c1-24-19-14-13-18(17-20(19)25-2)11-7-5-3-4-6-8-12-21(23)22-15-9-10-16-22/h13-14,17H,3-12,15-16H2,1-2H3
InChIKey CNQWQJWFBRGCPO-UHFFFAOYSA-N
Molecular Weight 347.499 g/mol
SMILES C(N1CCCC1)(=O)CCCCCCCCc1cc(OC)c(cc1)OC
SPLASH splash10-03dj-0907000000-98ae3e1188e64bfc1d96
Source of Spectrum E1-45-695-0
Wiley ID 1553789