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2-[2-[(E)-1-oxohept-2-enyl]-1H-indol-3-yl]acetic acid methyl ester
SpectraBase Compound ID 2Xjh1xJklsQ
InChI InChI=1S/C18H21NO3/c1-3-4-5-6-11-16(20)18-14(12-17(21)22-2)13-9-7-8-10-15(13)19-18/h6-11,19H,3-5,12H2,1-2H3/b11-6+
InChIKey JAYARIKLNOTRQJ-IZZDOVSWSA-N
Mol Weight 299.37 g/mol
Molecular Formula C18H21NO3
Exact Mass 299.152144 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9UeUzP5jLdQ
Name 2-[2-[(E)-1-oxohept-2-enyl]-1H-indol-3-yl]acetic acid methyl ester
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Formula C18H21NO3
InChI InChI=1S/C18H21NO3/c1-3-4-5-6-11-16(20)18-14(12-17(21)22-2)13-9-7-8-10-15(13)19-18/h6-11,19H,3-5,12H2,1-2H3/b11-6+
InChIKey JAYARIKLNOTRQJ-IZZDOVSWSA-N
Molecular Weight 299.370 g/mol
SMILES [nH]1c2c(c(c1C(\C=C\CCCC)=O)CC(=O)OC)cccc2
SPLASH splash10-00o4-0940000000-0ba051358aa947b642b9
Source of Spectrum SO-20-432-4
Synonyms 2-[2-[(E)-hept-2-enoyl]-1H-indol-3-yl]acetic acid methyl ester Methyl 2-[2-[(E)-hept-2-enoyl]-1H-indol-3-yl]acetate Methyl 2-[2-[(E)-hept-2-enoyl]-1H-indol-3-yl]ethanoate
Wiley ID 877493