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1H-Indole-2-acetic acid, 3-[2-(3,4-dihydro-4-oxo-1(2H)-pyridinyl)ethyl]-.alpha.-methylene-, methyl ester
SpectraBase Compound ID DtVWKWnt277
InChI InChI=1S/C19H20N2O3/c1-13(19(23)24-2)18-16(15-5-3-4-6-17(15)20-18)9-12-21-10-7-14(22)8-11-21/h3-7,10,20H,1,8-9,11-12H2,2H3
InChIKey UXSXNBYXQHPABZ-UHFFFAOYSA-N
Mol Weight 324.38 g/mol
Molecular Formula C19H20N2O3
Exact Mass 324.147393 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Jjxaab0OV0z
Name 1H-Indole-2-acetic acid, 3-[2-(3,4-dihydro-4-oxo-1(2H)-pyridinyl)ethyl]-.alpha.-methylene-, methyl ester
CAS Registry Number 103027-22-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H20N2O3
InChI InChI=1S/C19H20N2O3/c1-13(19(23)24-2)18-16(15-5-3-4-6-17(15)20-18)9-12-21-10-7-14(22)8-11-21/h3-7,10,20H,1,8-9,11-12H2,2H3
InChIKey UXSXNBYXQHPABZ-UHFFFAOYSA-N
Molecular Weight 324.380 g/mol
SMILES [nH]1c2ccccc2c(c1C(C(=O)OC)=C)CCN1C=CC(CC1)=O
SPLASH splash10-0gx0-7920000000-c71d07945c24cd7b473b
Source of Spectrum J-51-2925-32
Synonyms Desethyl-15-oxosecodine Methyl 2-{3-[2-(4-oxo-3,4-dihydro-1(2H)-pyridinyl)ethyl]-1H-indol-2-yl}acrylate
Wiley ID 1323333