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RETROFRACTAMIDE-D
SpectraBase Compound ID EVqLduHDzVA
InChI InChI=1S/C21H27NO3/c1-17(2)15-22-21(23)11-9-7-5-3-4-6-8-10-18-12-13-19-20(14-18)25-16-24-19/h5,7-14,17H,3-4,6,15-16H2,1-2H3,(H,22,23)/b7-5+,10-8+,11-9+
InChIKey QVKVGYVXAAXMSX-HJHGIKLDSA-N
Mol Weight 341.45 g/mol
Molecular Formula C21H27NO3
Exact Mass 341.199094 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JhWwoxXBHrW
Name 10-(3',4'-Methylenedioxyphenyl)-2E,4E,9E-decatrienoic acid isobutylamide
Alternate Name(s) (2E,4E,9E)-10-(1,3-benzodioxol-5-yl)-N-isobutyl-2,4,9-decatrienamide
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Formula C21H27NO3
InChI InChI=1S/C21H27NO3/c1-17(2)15-22-21(23)11-9-7-5-3-4-6-8-10-18-12-13-19-20(14-18)25-16-24-19/h5,7-14,17H,3-4,6,15-16H2,1-2H3,(H,22,23)/b7-5+,10-8+,11-9+
InChIKey QVKVGYVXAAXMSX-HJHGIKLDSA-N
Molecular Weight 341.451 g/mol
SMILES N(C(\C=C\C=C\CCC\C=C\c1cc2c(OCO2)cc1)=O)CC(C)C
SPLASH splash10-0006-0947000000-e6afc42b4b9b16ca320e
Source of Spectrum F-50-11120-2
Wiley ID 789543