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Methyl (E)-6-(3-cyanoindol-7-yl)-4-methyl-4-hexenoate
SpectraBase Compound ID EfYijDlO63j
InChI InChI=1S/C17H18N2O2/c1-12(7-9-16(20)21-2)6-8-13-4-3-5-15-14(10-18)11-19-17(13)15/h3-6,11,19H,7-9H2,1-2H3/b12-6+
InChIKey RKWSALBATREOQN-WUXMJOGZSA-N
Mol Weight 282.34 g/mol
Molecular Formula C17H18N2O2
Exact Mass 282.136828 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KSrGQQrgJX5
Name Methyl (E)-6-(3-cyanoindol-7-yl)-4-methyl-4-hexenoate
Alternate Name(s) Methyl (4E)-6-(3-cyano-1H-indol-7-yl)-4-methyl-4-hexenoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H18N2O2
InChI InChI=1S/C17H18N2O2/c1-12(7-9-16(20)21-2)6-8-13-4-3-5-15-14(10-18)11-19-17(13)15/h3-6,11,19H,7-9H2,1-2H3/b12-6+
InChIKey RKWSALBATREOQN-WUXMJOGZSA-N
Molecular Weight 282.343 g/mol
SMILES [nH]1cc(c2c1c(ccc2)C\C=C\(CCC(=O)OC)C)C#N
SPLASH splash10-05tg-0900000000-97323d10fbf3fa17929b
Source of Spectrum F-56-2589-19
Wiley ID 856576